#------------------------------------------------------------------------------
#$Date: 2025-07-01 01:15:43 +0300 (Tue, 01 Jul 2025) $
#$Revision: 300268 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/49/1574983.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1574983
loop_
_publ_author_name
'Ghosh, Moushakhi'
'Gaurav, Kumar'
'Panwaria, Prakash'
'Panday, Rishukumar'
'Tothadi, Srinu'
'Khan, Shabana'
_publ_section_title
;
 Driving Diverse Bond Functionalisation with N-Heterocyclic
 Silylene-Coinage Metal-Aryl Complexes
;
_journal_name_full               'Chemical Science'
_journal_paper_doi               10.1039/D5SC00879D
_journal_year                    2025
_chemical_formula_moiety         'C36 H64 Ag N3 Si3'
_chemical_formula_sum            'C36 H64 Ag N3 Si3'
_chemical_formula_weight         731.04
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2025-01-16
_audit_creation_method
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_audit_update_record
;
2025-01-23 deposited with the CCDC.	2025-06-30 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 97.745(7)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.365(5)
_cell_length_b                   20.278(11)
_cell_length_c                   21.736(12)
_cell_measurement_reflns_used    9916
_cell_measurement_temperature    100
_cell_measurement_theta_max      25.71
_cell_measurement_theta_min      2.41
_cell_volume                     4090(4)
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0905
_diffrn_reflns_av_unetI/netI     0.0449
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.989
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_k_min       -27
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            105327
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.989
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.721
_diffrn_reflns_theta_min         1.891
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.607
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.4833
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1483 before and 0.0716 after correction. The Ratio of minimum to maximum transmission is 0.6481. The λ/2 correction factor is Not present.'
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.187
_exptl_crystal_description       block
_exptl_crystal_F_000             1560
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.455
_refine_diff_density_min         -0.773
_refine_diff_density_rms         0.073
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     428
_refine_ls_number_reflns         10482
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.066
_refine_ls_R_factor_all          0.0547
_refine_ls_R_factor_gt           0.0390
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0272P)²+3.7501P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0834
_refine_ls_wR_factor_ref         0.0899
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8538
_reflns_number_total             10482
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5sc00879d2.cif
_cod_data_source_block           a1_a_CCDC7
_cod_database_code               1574983
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_max   0.970
_shelx_estimated_absorpt_t_min   0.920
_olex2_refinement_description
;
1. Others
 Sof(H7B)=Sof(C1AA)=Sof(H1AA)=Sof(H1AB)=Sof(H1AC)=1-FVAR(1)
 Sof(H7A)=Sof(C0AA)=Sof(H0AA)=Sof(H0AB)=Sof(H0AC)=FVAR(1)
 Sof(C2AA)=Sof(H2AA)=Sof(H2AB)=Sof(H2AC)=1-FVAR(2)
 Sof(C3AA)=Sof(H3AA)=Sof(H3AB)=Sof(H3AC)=FVAR(2)
2.a Ternary CH refined with riding coordinates:
 C13(H13), C7(H7A), C7(H7B), C10(H10)
2.b Aromatic/amide H refined with riding coordinates:
 C18(H18), C5(H5), C22(H22), C3(H3), C21(H21), C19(H19), C20(H20)
2.c Idealised Me refined as rotating group:
 C25(H25A,H25B,H25C), C29(H29A,H29B,H29C), C34(H34A,H34B,H34C), C28(H28A,H28B,
 H28C), C36(H36A,H36B,H36C), C35(H35A,H35B,H35C), C15(H15A,H15B,H15C), C14(H14A,
 H14B,H14C), C32(H32A,H32B,H32C), C12(H12A,H12B,H12C), C24(H24A,H24B,H24C),
 C33(H33A,H33B,H33C), C30(H30A,H30B,H30C), C26(H26A,H26B,H26C), C31(H31A,H31B,
 H31C), C11(H11A,H11B,H11C), C0AA(H0AA,H0AB,H0AC), C1AA(H1AA,H1AB,H1AC),
 C2AA(H2AA,H2AB,H2AC), C3AA(H3AA,H3AB,H3AC)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.44153(2) 0.29401(2) 0.38851(2) 0.02159(5) Uani 1 1 d . . . . .
Si1 Si 0.62614(7) 0.21269(3) 0.41426(3) 0.01720(12) Uani 1 1 d . . . . .
Si3 Si 0.71315(8) 0.26437(4) 0.53878(3) 0.02567(15) Uani 1 1 d . . . . .
Si2 Si 0.87009(8) 0.14119(4) 0.50121(3) 0.03073(17) Uani 1 1 d . . . . .
N3 N 0.7167(2) 0.19369(9) 0.34625(8) 0.0178(4) Uani 1 1 d . . . . .
N1 N 0.7434(2) 0.20448(10) 0.48265(8) 0.0213(4) Uani 1 1 d . . . . .
N2 N 0.5577(2) 0.13307(9) 0.38018(8) 0.0195(4) Uani 1 1 d . . . . .
C17 C 0.5909(2) 0.11445(11) 0.26746(10) 0.0200(4) Uani 1 1 d . . . . .
C1 C 0.2685(2) 0.35878(11) 0.35439(11) 0.0212(5) Uani 1 1 d . . . . .
C16 C 0.6236(2) 0.14475(11) 0.32998(10) 0.0180(4) Uani 1 1 d . . . . .
C6 C 0.1933(2) 0.39533(11) 0.39468(10) 0.0207(5) Uani 1 1 d . . . . .
C27 C 0.8119(3) 0.23139(12) 0.30997(11) 0.0229(5) Uani 1 1 d . . . . .
C18 C 0.4816(3) 0.14113(12) 0.22510(11) 0.0250(5) Uani 1 1 d . . . . .
H18 H 0.427372 0.177638 0.236597 0.030 Uiso 1 1 calc R . . . .
C2 C 0.2224(2) 0.36547(11) 0.29027(11) 0.0216(5) Uani 1 1 d . . . . .
C5 C 0.0784(3) 0.43630(12) 0.37225(11) 0.0248(5) Uani 1 1 d . . . . .
H5 H 0.029755 0.460099 0.400816 0.030 Uiso 1 1 calc R . . . .
C22 C 0.6692(3) 0.06070(12) 0.25048(11) 0.0257(5) Uani 1 1 d . . . . .
H22 H 0.743214 0.042061 0.279442 0.031 Uiso 1 1 calc R . . . .
C13 C 0.3043(3) 0.33143(12) 0.24320(11) 0.0242(5) Uani 1 1 d . . . . .
H13 H 0.373656 0.300050 0.266815 0.029 Uiso 1 1 calc R . . . .
C3 C 0.1065(3) 0.40670(13) 0.26858(11) 0.0264(5) Uani 1 1 d . . . . .
H3 H 0.076773 0.409975 0.225144 0.032 Uiso 1 1 calc R . . . .
C7 C 0.2388(3) 0.39173(12) 0.46491(11) 0.0258(5) Uani 1 1 d . . . . .
H7A H 0.313396 0.356462 0.473680 0.031 Uiso 0.640(11) 1 calc R . P A 1
H7B H 0.345727 0.385636 0.471025 0.031 Uiso 0.360(11) 1 calc R . P A 2
C4 C 0.0337(3) 0.44304(13) 0.30898(12) 0.0288(5) Uani 1 1 d . . . . .
C21 C 0.6392(3) 0.03437(13) 0.19145(12) 0.0325(6) Uani 1 1 d . . . . .
H21 H 0.692839 -0.002249 0.179784 0.039 Uiso 1 1 calc R . . . .
C19 C 0.4519(3) 0.11439(14) 0.16614(12) 0.0334(6) Uani 1 1 d . . . . .
H19 H 0.377161 0.132406 0.137125 0.040 Uiso 1 1 calc R . . . .
C23 C 0.4333(3) 0.08990(12) 0.38821(12) 0.0284(5) Uani 1 1 d . . . . .
C25 C 0.4252(3) 0.08967(14) 0.45794(12) 0.0361(6) Uani 1 1 d . . . . .
H25A H 0.515988 0.072890 0.480109 0.054 Uiso 1 1 calc GR . . . .
H25B H 0.345622 0.061279 0.466623 0.054 Uiso 1 1 calc GR . . . .
H25C H 0.408837 0.134687 0.471824 0.054 Uiso 1 1 calc GR . . . .
C20 C 0.5316(3) 0.06132(14) 0.14963(12) 0.0348(6) Uani 1 1 d . . . . .
H20 H 0.511729 0.043316 0.109026 0.042 Uiso 1 1 calc R . . . .
C29 C 0.7259(3) 0.27001(14) 0.25751(12) 0.0359(6) Uani 1 1 d . . . . .
H29A H 0.674989 0.239245 0.227411 0.054 Uiso 1 1 calc GR . . . .
H29B H 0.791499 0.297357 0.236871 0.054 Uiso 1 1 calc GR . . . .
H29C H 0.655840 0.298309 0.274441 0.054 Uiso 1 1 calc GR . . . .
C34 C 0.8658(3) 0.26987(17) 0.60331(12) 0.0421(7) Uani 1 1 d . . . . .
H34A H 0.878267 0.227268 0.624633 0.063 Uiso 1 1 calc GR . . . .
H34B H 0.844810 0.303924 0.632812 0.063 Uiso 1 1 calc GR . . . .
H34C H 0.954367 0.281324 0.586368 0.063 Uiso 1 1 calc GR . . . .
C28 C 0.8933(4) 0.27944(16) 0.35528(13) 0.0459(8) Uani 1 1 d . . . . .
H28A H 0.824719 0.308388 0.372402 0.069 Uiso 1 1 calc GR . . . .
H28B H 0.958325 0.306073 0.333659 0.069 Uiso 1 1 calc GR . . . .
H28C H 0.949581 0.254898 0.389075 0.069 Uiso 1 1 calc GR . . . .
C36 C 0.6982(3) 0.34937(14) 0.50660(13) 0.0388(7) Uani 1 1 d . . . . .
H36A H 0.776820 0.357261 0.481953 0.058 Uiso 1 1 calc GR . . . .
H36B H 0.704498 0.381265 0.540729 0.058 Uiso 1 1 calc GR . . . .
H36C H 0.605538 0.354409 0.480138 0.058 Uiso 1 1 calc GR . . . .
C35 C 0.5455(3) 0.24192(16) 0.57184(14) 0.0423(7) Uani 1 1 d . . . . .
H35A H 0.462555 0.244539 0.539210 0.063 Uiso 1 1 calc GR . . . .
H35B H 0.531685 0.272571 0.605399 0.063 Uiso 1 1 calc GR . . . .
H35C H 0.554235 0.196872 0.588250 0.063 Uiso 1 1 calc GR . . . .
C15 C 0.2097(3) 0.29143(16) 0.19466(14) 0.0418(7) Uani 1 1 d . . . . .
H15A H 0.157961 0.257749 0.215246 0.063 Uiso 1 1 calc GR . . . .
H15B H 0.269956 0.270044 0.166950 0.063 Uiso 1 1 calc GR . . . .
H15C H 0.140219 0.320677 0.170435 0.063 Uiso 1 1 calc GR . . . .
C10 C -0.0889(3) 0.48975(16) 0.28491(13) 0.0426(7) Uani 1 1 d . . . . .
H10 H -0.090322 0.494572 0.239043 0.051 Uiso 1 1 calc R . . . .
C14 C 0.3931(3) 0.38110(15) 0.21184(15) 0.0452(8) Uani 1 1 d . . . . .
H14A H 0.328443 0.410379 0.185209 0.068 Uiso 1 1 calc GR . . . .
H14B H 0.455848 0.357585 0.186590 0.068 Uiso 1 1 calc GR . . . .
H14C H 0.452233 0.407256 0.243573 0.068 Uiso 1 1 calc GR . . . .
C32 C 0.8344(4) 0.09793(16) 0.57356(14) 0.0480(8) Uani 1 1 d . . . . .
H32A H 0.843040 0.129386 0.608097 0.072 Uiso 1 1 calc GR . . . .
H32B H 0.904689 0.062331 0.583136 0.072 Uiso 1 1 calc GR . . . .
H32C H 0.736913 0.079407 0.567384 0.072 Uiso 1 1 calc GR . . . .
C12 C -0.0692(3) 0.55800(15) 0.31409(16) 0.0450(8) Uani 1 1 d . . . . .
H12A H -0.081459 0.555365 0.358091 0.067 Uiso 1 1 calc GR . . . .
H12B H -0.141039 0.588209 0.292706 0.067 Uiso 1 1 calc GR . . . .
H12C H 0.027745 0.574320 0.310263 0.067 Uiso 1 1 calc GR . . . .
C24 C 0.2929(3) 0.11769(17) 0.35415(14) 0.0436(7) Uani 1 1 d . . . . .
H24A H 0.280070 0.163130 0.367748 0.065 Uiso 1 1 calc GR . . . .
H24B H 0.211810 0.090657 0.363526 0.065 Uiso 1 1 calc GR . . . .
H24C H 0.296712 0.117122 0.309318 0.065 Uiso 1 1 calc GR . . . .
C33 C 0.8640(4) 0.07599(16) 0.44054(15) 0.0524(9) Uani 1 1 d . . . . .
H33A H 0.769043 0.054817 0.435353 0.079 Uiso 1 1 calc GR . . . .
H33B H 0.938483 0.042937 0.453237 0.079 Uiso 1 1 calc GR . . . .
H33C H 0.881168 0.095909 0.401126 0.079 Uiso 1 1 calc GR . . . .
C30 C 0.9182(3) 0.18504(16) 0.28419(17) 0.0478(8) Uani 1 1 d . . . . .
H30A H 0.970391 0.159340 0.318232 0.072 Uiso 1 1 calc GR . . . .
H30B H 0.986922 0.211006 0.263987 0.072 Uiso 1 1 calc GR . . . .
H30C H 0.865462 0.155080 0.253847 0.072 Uiso 1 1 calc GR . . . .
C26 C 0.4594(4) 0.02015(15) 0.36666(16) 0.0516(9) Uani 1 1 d . . . . .
H26A H 0.465810 0.020444 0.322031 0.077 Uiso 1 1 calc GR . . . .
H26B H 0.379445 -0.008294 0.374829 0.077 Uiso 1 1 calc GR . . . .
H26C H 0.549683 0.003343 0.389223 0.077 Uiso 1 1 calc GR . . . .
C31 C 1.0600(3) 0.17184(19) 0.51141(15) 0.0515(9) Uani 1 1 d . . . . .
H31A H 1.083018 0.189188 0.471817 0.077 Uiso 1 1 calc GR . . . .
H31B H 1.125634 0.135460 0.525058 0.077 Uiso 1 1 calc GR . . . .
H31C H 1.071081 0.206932 0.542684 0.077 Uiso 1 1 calc GR . . . .
C11 C -0.2336(3) 0.46164(18) 0.2966(2) 0.0831(16) Uani 1 1 d . . . . .
H11A H -0.250779 0.419719 0.274446 0.125 Uiso 1 1 calc GR . . . .
H11B H -0.310398 0.492864 0.281772 0.125 Uiso 1 1 calc GR . . . .
H11C H -0.232621 0.454252 0.341247 0.125 Uiso 1 1 calc GR . . . .
C0AA C 0.1093(6) 0.3744(4) 0.4993(2) 0.0460(18) Uani 0.640(11) 1 d . . P A 1
H0AA H 0.036020 0.408996 0.491837 0.069 Uiso 0.640(11) 1 calc GR . P A 1
H0AB H 0.142014 0.370948 0.543959 0.069 Uiso 0.640(11) 1 calc GR . P A 1
H0AC H 0.067858 0.332145 0.483904 0.069 Uiso 0.640(11) 1 calc GR . P A 1
C1AA C 0.1780(12) 0.3330(6) 0.4932(4) 0.042(3) Uani 0.360(11) 1 d . . P A 2
H1AA H 0.072795 0.336567 0.488636 0.063 Uiso 0.360(11) 1 calc GR . P A 2
H1AB H 0.216304 0.330694 0.537426 0.063 Uiso 0.360(11) 1 calc GR . P A 2
H1AC H 0.205055 0.292963 0.472285 0.063 Uiso 0.360(11) 1 calc GR . P A 2
C2AA C 0.209(2) 0.4532(7) 0.5029(5) 0.047(5) Uani 0.34(2) 1 d . . P A 2
H2AA H 0.254382 0.491839 0.486528 0.071 Uiso 0.34(2) 1 calc GR . P A 2
H2AB H 0.249409 0.446566 0.546508 0.071 Uiso 0.34(2) 1 calc GR . P A 2
H2AC H 0.105000 0.460342 0.499986 0.071 Uiso 0.34(2) 1 calc GR . P A 2
C3AA C 0.3021(16) 0.4550(4) 0.4885(3) 0.069(4) Uani 0.66(2) 1 d . . P A 1
H3AA H 0.390991 0.463302 0.470623 0.104 Uiso 0.66(2) 1 calc GR . P A 1
H3AB H 0.323937 0.453020 0.533880 0.104 Uiso 0.66(2) 1 calc GR . P A 1
H3AC H 0.233355 0.490763 0.476800 0.104 Uiso 0.66(2) 1 calc GR . P A 1
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Ag1 Si1 172.21(7) . . ?
N3 Si1 Ag1 110.60(7) . . ?
N3 Si1 N2 70.67(8) . . ?
N3 Si1 C16 35.73(8) . . ?
N1 Si1 Ag1 128.26(7) . . ?
N1 Si1 N3 111.18(10) . . ?
N1 Si1 N2 113.82(10) . . ?
N1 Si1 C16 124.45(9) . . ?
N2 Si1 Ag1 107.81(7) . . ?
N2 Si1 C16 35.97(8) . . ?
C16 Si1 Ag1 107.29(6) . . ?
N1 Si3 C34 112.43(12) . . ?
N1 Si3 C36 112.80(12) . . ?
N1 Si3 C35 108.56(12) . . ?
C34 Si3 C35 108.89(14) . . ?
C36 Si3 C34 103.80(14) . . ?
C36 Si3 C35 110.25(15) . . ?
N1 Si2 C32 110.12(12) . . ?
N1 Si2 C33 113.60(12) . . ?
N1 Si2 C31 112.76(14) . . ?
C32 Si2 C31 109.35(15) . . ?
C33 Si2 C32 105.69(16) . . ?
C33 Si2 C31 104.94(16) . . ?
C16 N3 Si1 90.73(13) . . ?
C16 N3 C27 131.35(18) . . ?
C27 N3 Si1 134.06(15) . . ?
Si1 N1 Si3 112.55(11) . . ?
Si1 N1 Si2 126.67(11) . . ?
Si2 N1 Si3 120.54(11) . . ?
C16 N2 Si1 89.95(14) . . ?
C16 N2 C23 130.64(19) . . ?
C23 N2 Si1 134.43(15) . . ?
C18 C17 C16 119.2(2) . . ?
C22 C17 C16 121.1(2) . . ?
C22 C17 C18 119.8(2) . . ?
C6 C1 Ag1 121.81(16) . . ?
C6 C1 C2 116.9(2) . . ?
C2 C1 Ag1 121.25(16) . . ?
N3 C16 Si1 53.54(11) . . ?
N3 C16 N2 105.68(19) . . ?
N3 C16 C17 126.56(19) . . ?
N2 C16 Si1 54.08(11) . . ?
N2 C16 C17 127.5(2) . . ?
C17 C16 Si1 163.67(16) . . ?
C1 C6 C7 120.0(2) . . ?
C5 C6 C1 121.6(2) . . ?
C5 C6 C7 118.4(2) . . ?
N3 C27 C29 111.7(2) . . ?
N3 C27 C28 105.79(19) . . ?
N3 C27 C30 110.3(2) . . ?
C29 C27 C30 110.3(2) . . ?
C28 C27 C29 109.0(2) . . ?
C28 C27 C30 109.7(2) . . ?
C17 C18 H18 120.1 . . ?
C19 C18 C17 119.9(2) . . ?
C19 C18 H18 120.1 . . ?
C1 C2 C13 120.4(2) . . ?
C3 C2 C1 120.7(2) . . ?
C3 C2 C13 118.8(2) . . ?
C6 C5 H5 119.3 . . ?
C4 C5 C6 121.4(2) . . ?
C4 C5 H5 119.3 . . ?
C17 C22 H22 120.0 . . ?
C21 C22 C17 120.0(2) . . ?
C21 C22 H22 120.0 . . ?
C2 C13 H13 107.1 . . ?
C15 C13 C2 114.2(2) . . ?
C15 C13 H13 107.1 . . ?
C15 C13 C14 110.2(2) . . ?
C14 C13 C2 110.8(2) . . ?
C14 C13 H13 107.1 . . ?
C2 C3 H3 119.1 . . ?
C4 C3 C2 121.8(2) . . ?
C4 C3 H3 119.1 . . ?
C6 C7 H7A 108.5 . . ?
C6 C7 H7B 106.1 . . ?
C6 C7 C0AA 111.2(3) . . ?
C6 C7 C2AA 116.8(4) . . ?
C0AA C7 H7A 108.5 . . ?
C1AA C7 C6 112.3(4) . . ?
C1AA C7 H7B 106.1 . . ?
C1AA C7 C2AA 108.6(10) . . ?
C2AA C7 H7B 106.1 . . ?
C3AA C7 C6 110.5(3) . . ?
C3AA C7 H7A 108.5 . . ?
C3AA C7 C0AA 109.5(7) . . ?
C5 C4 C3 117.6(2) . . ?
C5 C4 C10 120.9(2) . . ?
C3 C4 C10 121.5(2) . . ?
C22 C21 H21 120.1 . . ?
C20 C21 C22 119.9(2) . . ?
C20 C21 H21 120.1 . . ?
C18 C19 H19 120.1 . . ?
C18 C19 C20 119.8(3) . . ?
C20 C19 H19 120.1 . . ?
N2 C23 C25 105.2(2) . . ?
N2 C23 C24 111.3(2) . . ?
N2 C23 C26 110.5(2) . . ?
C25 C23 C24 109.1(2) . . ?
C26 C23 C25 109.5(2) . . ?
C26 C23 C24 111.0(3) . . ?
C23 C25 H25A 109.5 . . ?
C23 C25 H25B 109.5 . . ?
C23 C25 H25C 109.5 . . ?
H25A C25 H25B 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C21 C20 C19 120.7(2) . . ?
C21 C20 H20 119.7 . . ?
C19 C20 H20 119.7 . . ?
C27 C29 H29A 109.5 . . ?
C27 C29 H29B 109.5 . . ?
C27 C29 H29C 109.5 . . ?
H29A C29 H29B 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
Si3 C34 H34A 109.5 . . ?
Si3 C34 H34B 109.5 . . ?
Si3 C34 H34C 109.5 . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28B 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
Si3 C36 H36A 109.5 . . ?
Si3 C36 H36B 109.5 . . ?
Si3 C36 H36C 109.5 . . ?
H36A C36 H36B 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
Si3 C35 H35A 109.5 . . ?
Si3 C35 H35B 109.5 . . ?
Si3 C35 H35C 109.5 . . ?
H35A C35 H35B 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C4 C10 H10 108.1 . . ?
C4 C10 C12 112.2(2) . . ?
C4 C10 C11 110.8(3) . . ?
C12 C10 H10 108.1 . . ?
C11 C10 H10 108.1 . . ?
C11 C10 C12 109.3(3) . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14B 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
Si2 C32 H32A 109.5 . . ?
Si2 C32 H32B 109.5 . . ?
Si2 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12B 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C23 C24 H24A 109.5 . . ?
C23 C24 H24B 109.5 . . ?
C23 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
Si2 C33 H33A 109.5 . . ?
Si2 C33 H33B 109.5 . . ?
Si2 C33 H33C 109.5 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C27 C30 H30A 109.5 . . ?
C27 C30 H30B 109.5 . . ?
C27 C30 H30C 109.5 . . ?
H30A C30 H30B 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C23 C26 H26A 109.5 . . ?
C23 C26 H26B 109.5 . . ?
C23 C26 H26C 109.5 . . ?
H26A C26 H26B 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
Si2 C31 H31A 109.5 . . ?
Si2 C31 H31B 109.5 . . ?
Si2 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C7 C0AA H0AA 109.5 . . ?
C7 C0AA H0AB 109.5 . . ?
C7 C0AA H0AC 109.5 . . ?
H0AA C0AA H0AB 109.5 . . ?
H0AA C0AA H0AC 109.5 . . ?
H0AB C0AA H0AC 109.5 . . ?
C7 C1AA H1AA 109.5 . . ?
C7 C1AA H1AB 109.5 . . ?
C7 C1AA H1AC 109.5 . . ?
H1AA C1AA H1AB 109.5 . . ?
H1AA C1AA H1AC 109.5 . . ?
H1AB C1AA H1AC 109.5 . . ?
C7 C2AA H2AA 109.5 . . ?
C7 C2AA H2AB 109.5 . . ?
C7 C2AA H2AC 109.5 . . ?
H2AA C2AA H2AB 109.5 . . ?
H2AA C2AA H2AC 109.5 . . ?
H2AB C2AA H2AC 109.5 . . ?
C7 C3AA H3AA 109.5 . . ?
C7 C3AA H3AB 109.5 . . ?
C7 C3AA H3AC 109.5 . . ?
H3AA C3AA H3AB 109.5 . . ?
H3AA C3AA H3AC 109.5 . . ?
H3AB C3AA H3AC 109.5 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Ag1 Si1 2.4002(11) . ?
Ag1 C1 2.139(2) . ?
Si1 N3 1.842(2) . ?
Si1 N1 1.733(2) . ?
Si1 N2 1.854(2) . ?
Si1 C16 2.290(2) . ?
Si3 N1 1.771(2) . ?
Si3 C34 1.866(3) . ?
Si3 C36 1.858(3) . ?
Si3 C35 1.869(3) . ?
Si2 N1 1.758(2) . ?
Si2 C32 1.870(3) . ?
Si2 C33 1.863(3) . ?
Si2 C31 1.869(3) . ?
N3 C16 1.337(3) . ?
N3 C27 1.480(3) . ?
N2 C16 1.345(3) . ?
N2 C23 1.487(3) . ?
C17 C16 1.485(3) . ?
C17 C18 1.391(3) . ?
C17 C22 1.391(3) . ?
C1 C6 1.407(3) . ?
C1 C2 1.409(3) . ?
C6 C5 1.394(3) . ?
C6 C7 1.530(3) . ?
C27 C29 1.521(4) . ?
C27 C28 1.516(4) . ?
C27 C30 1.530(4) . ?
C18 H18 0.9500 . ?
C18 C19 1.385(3) . ?
C2 C13 1.524(3) . ?
C2 C3 1.401(3) . ?
C5 H5 0.9500 . ?
C5 C4 1.389(3) . ?
C22 H22 0.9500 . ?
C22 C21 1.383(3) . ?
C13 H13 1.0000 . ?
C13 C15 1.518(4) . ?
C13 C14 1.524(4) . ?
C3 H3 0.9500 . ?
C3 C4 1.393(3) . ?
C7 H7A 1.0000 . ?
C7 H7B 1.0000 . ?
C7 C0AA 1.549(5) . ?
C7 C1AA 1.489(8) . ?
C7 C2AA 1.542(9) . ?
C7 C3AA 1.477(6) . ?
C4 C10 1.525(4) . ?
C21 H21 0.9500 . ?
C21 C20 1.376(4) . ?
C19 H19 0.9500 . ?
C19 C20 1.384(4) . ?
C23 C25 1.528(3) . ?
C23 C24 1.527(4) . ?
C23 C26 1.520(4) . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C20 H20 0.9500 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C10 H10 1.0000 . ?
C10 C12 1.523(4) . ?
C10 C11 1.523(5) . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C0AA H0AA 0.9800 . ?
C0AA H0AB 0.9800 . ?
C0AA H0AC 0.9800 . ?
C1AA H1AA 0.9800 . ?
C1AA H1AB 0.9800 . ?
C1AA H1AC 0.9800 . ?
C2AA H2AA 0.9800 . ?
C2AA H2AB 0.9800 . ?
C2AA H2AC 0.9800 . ?
C3AA H3AA 0.9800 . ?
C3AA H3AB 0.9800 . ?
C3AA H3AC 0.9800 . ?
