#------------------------------------------------------------------------------
#$Date: 2025-07-05 13:10:14 +0300 (Sat, 05 Jul 2025) $
#$Revision: 300370 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/42/1574278.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_1574278
loop_
_publ_author_name
'Malan, Frederick P.'
'Potgieter, Kariska'
'Meijboom, Reinout'
_publ_section_title
;
 Bis[(2-methoxyphenyl)diphenylphosphane-\kP](nitrito-κ2
 O,O′)silver(I)
;
_journal_coeditor_code           TK4116
_journal_issue                   3
_journal_name_full               IUCrData
_journal_page_first              x250193
_journal_paper_doi               10.1107/S2414314625001932
_journal_volume                  10
_journal_year                    2025
_chemical_formula_iupac          '[Ag (N O2) (C19 H17 O P)2]'
_chemical_formula_moiety         'C38 H34 Ag N O4 P2'
_chemical_formula_sum            'C38 H34 Ag N O4 P2'
_chemical_formula_weight         738.47
_chemical_name_systematic
Bis[(2-methoxyphenyl)diphenylphosphane-κP](nitrito-κ²O,O')silver(I)
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_method
;
Olex2 1.3-ac4
(compiled 2018.12.18 svn.r3554 for Rigaku Oxford Diffraction, GUI svn.r1)
;
_cell_angle_alpha                90
_cell_angle_beta                 106.080(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   22.6427(3)
_cell_length_b                   15.6971(2)
_cell_length_c                   20.1469(3)
_cell_measurement_reflns_used    36798
_cell_measurement_temperature    149.99(10)
_cell_measurement_theta_max      31.2970
_cell_measurement_theta_min      2.7880
_cell_volume                     6880.55(18)
_computing_cell_refinement
;
CrysAlisPro (Rigaku OD, 2022)
;
_computing_data_collection
;
CrysAlisPro (Rigaku OD, 2022)
;
_computing_data_reduction
;
CrysAlisPro (Rigaku OD, 2022)
;
_computing_molecular_graphics
;
Olex2 (Dolomanov et al.,  2009)
;
_computing_publication_material
;
Olex2 (Dolomanov et al.,  2009)
;
_computing_structure_refinement
;
SHELXL (Sheldrick, 2015b)
;
_computing_structure_solution
;
SHELXT (Sheldrick, 2015a)
;
_diffrn_ambient_temperature      149.99(10)
_diffrn_detector                 'Hybrid Pixel Array Detector'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.839
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy R, DW system, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0357
_diffrn_reflns_av_unetI/netI     0.0253
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            56728
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         31.118
_diffrn_reflns_theta_min         2.595
_diffrn_source                   'Rotating-anode X-ray tube'
_exptl_absorpt_coefficient_mu    0.717
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.03760
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(CrysAlisPro; Rigaku OD, 2022)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.420
_exptl_crystal_description       block
_exptl_crystal_F_000             3016
_exptl_crystal_size_max          0.313
_exptl_crystal_size_mid          0.274
_exptl_crystal_size_min          0.222
_refine_diff_density_max         1.692
_refine_diff_density_min         -0.929
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.070
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     417
_refine_ls_number_reflns         9287
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.070
_refine_ls_R_factor_all          0.0391
_refine_ls_R_factor_gt           0.0311
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0351P)²+8.2387P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0736
_refine_ls_wR_factor_ref         0.0760
_reflns_number_gt                7975
_reflns_number_total             9287
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            tk4116.cif
_cod_data_source_block           I
_cod_database_code               1574278
#BEGIN Tags that were not found in dictionaries:
_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.
;
_shelxl_version_number           2.013
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag Ag1 0.73700(2) 0.56462(2) 0.38969(2) 0.02206(5) Uani d 1 . .
P P1 0.65137(2) 0.47508(3) 0.39633(2) 0.01960(9) Uani d 1 . .
P P2 0.84579(2) 0.54168(3) 0.43873(2) 0.02195(9) Uani d 1 . .
O O3 0.67728(7) 0.53424(9) 0.53680(7) 0.0338(3) Uani d 1 . .
O O4 0.83502(7) 0.69983(10) 0.49956(8) 0.0400(3) Uani d 1 . .
O O2 0.71068(10) 0.58520(12) 0.26215(9) 0.0567(5) Uani d 1 . .
O O1 0.70419(10) 0.69047(11) 0.32257(9) 0.0568(5) Uani d 1 . .
C C18 0.67471(8) 0.44718(11) 0.53731(10) 0.0251(4) Uani d 1 . .
C C13 0.66033(8) 0.40809(11) 0.47215(9) 0.0230(3) Uani d 1 . .
C C26 0.86925(8) 0.49997(11) 0.52714(9) 0.0244(3) Uani d 1 . .
C C1 0.64164(8) 0.39815(11) 0.32640(9) 0.0238(3) Uani d 1 . .
C C20 0.87211(8) 0.46280(11) 0.38685(9) 0.0227(3) Uani d 1 . .
C C17 0.68459(9) 0.39840(14) 0.59698(10) 0.0322(4) Uani d 1 . .
H H17 0.6944 0.4252 0.6410 0.039 Uiso calc 1 . .
N N1 0.69803(10) 0.66201(13) 0.26371(10) 0.0453(5) Uani d 1 . .
C C32 0.89811(8) 0.63093(11) 0.44337(9) 0.0239(3) Uani d 1 . .
C C7 0.57573(8) 0.52308(11) 0.38389(9) 0.0236(3) Uani d 1 . .
C C16 0.68000(10) 0.31062(14) 0.59185(12) 0.0380(5) Uani d 1 . .
H H16 0.6867 0.2773 0.6326 0.046 Uiso calc 1 . .
C C27 0.83098(9) 0.44130(12) 0.54679(11) 0.0318(4) Uani d 1 . .
H H27 0.7936 0.4244 0.5146 0.038 Uiso calc 1 . .
C C34 0.98944(9) 0.69799(13) 0.42789(11) 0.0338(4) Uani d 1 . .
H H34 1.0243 0.6965 0.4104 0.041 Uiso calc 1 . .
C C14 0.65625(10) 0.31942(12) 0.46864(11) 0.0321(4) Uani d 1 . .
H H14 0.6468 0.2920 0.4249 0.038 Uiso calc 1 . .
C C25 0.91678(8) 0.40200(12) 0.41489(10) 0.0279(4) Uani d 1 . .
H H25 0.9363 0.4017 0.4631 0.033 Uiso calc 1 . .
C C35 0.97823(10) 0.76861(13) 0.46359(12) 0.0393(5) Uani d 1 . .
H H35 1.0062 0.8151 0.4713 0.047 Uiso calc 1 . .
C C33 0.94915(8) 0.62915(12) 0.41780(10) 0.0275(4) Uani d 1 . .
H H33 0.9566 0.5805 0.3932 0.033 Uiso calc 1 . .
C C28 0.84699(11) 0.40731(15) 0.61304(12) 0.0413(5) Uani d 1 . .
H H28 0.8210 0.3665 0.6256 0.050 Uiso calc 1 . .
C C23 0.90500(10) 0.34138(14) 0.30238(11) 0.0364(4) Uani d 1 . .
H H23 0.9159 0.2996 0.2737 0.044 Uiso calc 1 . .
C C37 0.88670(9) 0.70369(12) 0.47768(10) 0.0295(4) Uani d 1 . .
C C36 0.92706(10) 0.77295(13) 0.48830(11) 0.0366(5) Uani d 1 . .
H H36 0.9195 0.8222 0.5121 0.044 Uiso calc 1 . .
C C29 0.90059(11) 0.43267(15) 0.66074(12) 0.0420(5) Uani d 1 . .
H H29 0.9114 0.4095 0.7061 0.050 Uiso calc 1 . .
C C21 0.84448(10) 0.46245(14) 0.31582(11) 0.0358(4) Uani d 1 . .
H H21 0.8140 0.5037 0.2959 0.043 Uiso calc 1 . .
C C24 0.93294(10) 0.34175(13) 0.37256(11) 0.0344(4) Uani d 1 . .
H H24 0.9635 0.3004 0.3921 0.041 Uiso calc 1 . .
C C2 0.69423(9) 0.36501(14) 0.31357(11) 0.0357(5) Uani d 1 . .
H H2 0.7334 0.3835 0.3407 0.043 Uiso calc 1 . .
C C31 0.92311(9) 0.52493(13) 0.57568(11) 0.0329(4) Uani d 1 . .
H H31 0.9496 0.5649 0.5631 0.039 Uiso calc 1 . .
C C10 0.46111(10) 0.60076(16) 0.36229(12) 0.0425(5) Uani d 1 . .
H H10 0.4217 0.6265 0.3539 0.051 Uiso calc 1 . .
C C15 0.66583(11) 0.27086(14) 0.52812(12) 0.0417(5) Uani d 1 . .
H H15 0.6627 0.2105 0.5251 0.050 Uiso calc 1 . .
C C4 0.63425(12) 0.27957(15) 0.22160(12) 0.0452(6) Uani d 1 . .
H H4 0.6315 0.2396 0.1854 0.054 Uiso calc 1 . .
C C19 0.69918(13) 0.57647(16) 0.60203(12) 0.0484(6) Uani d 1 . .
H H19A 0.7034 0.6376 0.5944 0.073 Uiso calc 1 . .
H H19B 0.7392 0.5529 0.6271 0.073 Uiso calc 1 . .
H H19C 0.6699 0.5679 0.6292 0.073 Uiso calc 1 . .
C C30 0.93856(10) 0.49199(15) 0.64233(11) 0.0402(5) Uani d 1 . .
H H30 0.9751 0.5101 0.6752 0.048 Uiso calc 1 . .
C C11 0.50465(10) 0.63502(16) 0.33463(12) 0.0420(5) Uani d 1 . .
H H11 0.4957 0.6859 0.3083 0.050 Uiso calc 1 . .
C C3 0.69051(11) 0.30542(15) 0.26173(12) 0.0406(5) Uani d 1 . .
H H3 0.7270 0.2826 0.2541 0.049 Uiso calc 1 . .
C C8 0.53234(10) 0.49021(15) 0.41353(15) 0.0477(6) Uani d 1 . .
H H8 0.5417 0.4408 0.4418 0.057 Uiso calc 1 . .
C C22 0.86113(11) 0.40218(16) 0.27396(11) 0.0428(5) Uani d 1 . .
H H22 0.8423 0.4027 0.2256 0.051 Uiso calc 1 . .
C C12 0.56175(9) 0.59634(14) 0.34460(11) 0.0332(4) Uani d 1 . .
H H12 0.5912 0.6203 0.3244 0.040 Uiso calc 1 . .
C C38 0.82967(13) 0.75616(16) 0.55317(14) 0.0510(6) Uani d 1 . .
H H38A 0.8268 0.8150 0.5363 0.076 Uiso calc 1 . .
H H38B 0.8659 0.7502 0.5930 0.076 Uiso calc 1 . .
H H38C 0.7926 0.7419 0.5670 0.076 Uiso calc 1 . .
C C9 0.47504(11) 0.52905(17) 0.40224(17) 0.0562(7) Uani d 1 . .
H H9 0.4454 0.5056 0.4224 0.067 Uiso calc 1 . .
C C6 0.58518(10) 0.37091(18) 0.28587(14) 0.0539(7) Uani d 1 . .
H H6 0.5485 0.3928 0.2936 0.065 Uiso calc 1 . .
C C5 0.58173(12) 0.3116(2) 0.23378(16) 0.0690(10) Uani d 1 . .
H H5 0.5427 0.2931 0.2063 0.083 Uiso calc 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O1 Ag1 P1 . . 112.41(6) y
O1 Ag1 P2 . . 118.45(6) y
O1 Ag1 O2 . . 50.38(6) y
O2 Ag1 P1 . . 99.51(5) y
O2 Ag1 P2 . . 111.52(5) y
P1 Ag1 P2 . . 129.126(16) y
C13 P1 Ag1 . . 118.42(6) ?
C13 P1 C1 . . 103.16(8) ?
C13 P1 C7 . . 103.67(8) ?
C1 P1 Ag1 . . 105.57(6) ?
C1 P1 C7 . . 105.05(8) ?
C7 P1 Ag1 . . 119.15(6) ?
C26 P2 Ag1 . . 116.06(6) ?
C20 P2 Ag1 . . 108.97(6) ?
C20 P2 C26 . . 105.17(8) ?
C32 P2 Ag1 . . 118.82(6) ?
C32 P2 C26 . . 102.46(8) ?
C32 P2 C20 . . 103.93(8) ?
C18 O3 C19 . . 117.40(17) ?
C37 O4 C38 . . 118.59(18) ?
N1 O2 Ag1 . . 95.21(13) ?
N1 O1 Ag1 . . 100.27(13) ?
O3 C18 C13 . . 115.42(16) ?
O3 C18 C17 . . 124.04(17) ?
C17 C18 C13 . . 120.54(17) ?
C18 C13 P1 . . 118.41(13) ?
C14 C13 P1 . . 122.93(14) ?
C14 C13 C18 . . 118.60(17) ?
C27 C26 P2 . . 118.43(14) ?
C31 C26 P2 . . 122.95(15) ?
C31 C26 C27 . . 118.61(18) ?
C2 C1 P1 . . 117.79(14) ?
C6 C1 P1 . . 123.82(15) ?
C6 C1 C2 . . 118.40(18) ?
C25 C20 P2 . . 123.31(14) ?
C25 C20 C21 . . 118.88(17) ?
C21 C20 P2 . . 117.78(14) ?
C18 C17 H17 . . 120.2 ?
C16 C17 C18 . . 119.55(19) ?
C16 C17 H17 . . 120.2 ?
O1 N1 O2 . . 114.14(18) ?
C33 C32 P2 . . 124.17(14) ?
C33 C32 C37 . . 119.15(17) ?
C37 C32 P2 . . 116.63(14) ?
C8 C7 P1 . . 122.60(15) ?
C12 C7 P1 . . 118.68(14) ?
C12 C7 C8 . . 118.70(17) ?
C17 C16 H16 . . 119.6 ?
C15 C16 C17 . . 120.81(19) ?
C15 C16 H16 . . 119.6 ?
C26 C27 H27 . . 119.7 ?
C28 C27 C26 . . 120.6(2) ?
C28 C27 H27 . . 119.7 ?
C35 C34 H34 . . 120.3 ?
C35 C34 C33 . . 119.40(19) ?
C33 C34 H34 . . 120.3 ?
C13 C14 H14 . . 119.6 ?
C15 C14 C13 . . 120.83(19) ?
C15 C14 H14 . . 119.6 ?
C20 C25 H25 . . 119.9 ?
C24 C25 C20 . . 120.22(18) ?
C24 C25 H25 . . 119.9 ?
C34 C35 H35 . . 119.4 ?
C34 C35 C36 . . 121.28(18) ?
C36 C35 H35 . . 119.4 ?
C32 C33 C34 . . 120.58(19) ?
C32 C33 H33 . . 119.7 ?
C34 C33 H33 . . 119.7 ?
C27 C28 H28 . . 119.9 ?
C29 C28 C27 . . 120.2(2) ?
C29 C28 H28 . . 119.9 ?
C24 C23 H23 . . 120.2 ?
C24 C23 C22 . . 119.64(19) ?
C22 C23 H23 . . 120.2 ?
O4 C37 C32 . . 114.68(16) ?
O4 C37 C36 . . 124.68(19) ?
C32 C37 C36 . . 120.63(19) ?
C35 C36 C37 . . 118.9(2) ?
C35 C36 H36 . . 120.5 ?
C37 C36 H36 . . 120.5 ?
C28 C29 H29 . . 120.1 ?
C28 C29 C30 . . 119.9(2) ?
C30 C29 H29 . . 120.1 ?
C20 C21 H21 . . 119.8 ?
C22 C21 C20 . . 120.43(19) ?
C22 C21 H21 . . 119.8 ?
C25 C24 H24 . . 119.7 ?
C23 C24 C25 . . 120.53(18) ?
C23 C24 H24 . . 119.7 ?
C1 C2 H2 . . 119.4 ?
C3 C2 C1 . . 121.11(19) ?
C3 C2 H2 . . 119.4 ?
C26 C31 H31 . . 119.6 ?
C30 C31 C26 . . 120.74(19) ?
C30 C31 H31 . . 119.6 ?
C11 C10 H10 . . 120.4 ?
C9 C10 H10 . . 120.4 ?
C9 C10 C11 . . 119.17(19) ?
C16 C15 C14 . . 119.7(2) ?
C16 C15 H15 . . 120.2 ?
C14 C15 H15 . . 120.2 ?
C3 C4 H4 . . 120.1 ?
C3 C4 C5 . . 119.7(2) ?
C5 C4 H4 . . 120.1 ?
O3 C19 H19A . . 109.5 ?
O3 C19 H19B . . 109.5 ?
O3 C19 H19C . . 109.5 ?
H19A C19 H19B . . 109.5 ?
H19A C19 H19C . . 109.5 ?
H19B C19 H19C . . 109.5 ?
C29 C30 C31 . . 120.0(2) ?
C29 C30 H30 . . 120.0 ?
C31 C30 H30 . . 120.0 ?
C10 C11 H11 . . 119.5 ?
C10 C11 C12 . . 121.0(2) ?
C12 C11 H11 . . 119.5 ?
C2 C3 H3 . . 120.1 ?
C4 C3 C2 . . 119.8(2) ?
C4 C3 H3 . . 120.1 ?
C7 C8 H8 . . 119.8 ?
C7 C8 C9 . . 120.4(2) ?
C9 C8 H8 . . 119.8 ?
C23 C22 C21 . . 120.3(2) ?
C23 C22 H22 . . 119.9 ?
C21 C22 H22 . . 119.9 ?
C7 C12 C11 . . 120.12(19) ?
C7 C12 H12 . . 119.9 ?
C11 C12 H12 . . 119.9 ?
O4 C38 H38A . . 109.5 ?
O4 C38 H38B . . 109.5 ?
O4 C38 H38C . . 109.5 ?
H38A C38 H38B . . 109.5 ?
H38A C38 H38C . . 109.5 ?
H38B C38 H38C . . 109.5 ?
C10 C9 C8 . . 120.5(2) ?
C10 C9 H9 . . 119.7 ?
C8 C9 H9 . . 119.7 ?
C1 C6 H6 . . 119.9 ?
C1 C6 C5 . . 120.2(2) ?
C5 C6 H6 . . 119.9 ?
C4 C5 C6 . . 120.7(2) ?
C4 C5 H5 . . 119.7 ?
C6 C5 H5 . . 119.7 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Ag1 O1 . 2.3931(16) y
Ag1 O2 . 2.4927(17) y
Ag1 P1 . 2.4283(4) y
Ag1 P2 . 2.4136(4) y
P1 C13 . 1.8190(18) ?
P1 C1 . 1.8220(18) ?
P1 C7 . 1.8238(17) ?
P2 C26 . 1.8328(19) ?
P2 C20 . 1.8237(18) ?
P2 C32 . 1.8204(18) ?
O3 C18 . 1.368(2) ?
O3 C19 . 1.432(2) ?
O4 C37 . 1.361(2) ?
O4 C38 . 1.427(3) ?
O2 N1 . 1.242(3) ?
O1 N1 . 1.238(3) ?
C18 C13 . 1.403(3) ?
C18 C17 . 1.390(3) ?
C13 C14 . 1.395(3) ?
C26 C27 . 1.395(3) ?
C26 C31 . 1.392(3) ?
C1 C2 . 1.388(3) ?
C1 C6 . 1.380(3) ?
C20 C25 . 1.392(2) ?
C20 C21 . 1.394(3) ?
C17 H17 . 0.9500 ?
C17 C16 . 1.383(3) ?
C32 C33 . 1.390(3) ?
C32 C37 . 1.396(3) ?
C7 C8 . 1.383(3) ?
C7 C12 . 1.382(3) ?
C16 H16 . 0.9500 ?
C16 C15 . 1.383(3) ?
C27 H27 . 0.9500 ?
C27 C28 . 1.389(3) ?
C34 H34 . 0.9500 ?
C34 C35 . 1.383(3) ?
C34 C33 . 1.392(3) ?
C14 H14 . 0.9500 ?
C14 C15 . 1.386(3) ?
C25 H25 . 0.9500 ?
C25 C24 . 1.389(3) ?
C35 H35 . 0.9500 ?
C35 C36 . 1.384(3) ?
C33 H33 . 0.9500 ?
C28 H28 . 0.9500 ?
C28 C29 . 1.382(3) ?
C23 H23 . 0.9500 ?
C23 C24 . 1.380(3) ?
C23 C22 . 1.382(3) ?
C37 C36 . 1.398(3) ?
C36 H36 . 0.9500 ?
C29 H29 . 0.9500 ?
C29 C30 . 1.386(3) ?
C21 H21 . 0.9500 ?
C21 C22 . 1.387(3) ?
C24 H24 . 0.9500 ?
C2 H2 . 0.9500 ?
C2 C3 . 1.387(3) ?
C31 H31 . 0.9500 ?
C31 C30 . 1.390(3) ?
C10 H10 . 0.9500 ?
C10 C11 . 1.370(3) ?
C10 C9 . 1.369(4) ?
C15 H15 . 0.9500 ?
C4 H4 . 0.9500 ?
C4 C3 . 1.368(3) ?
C4 C5 . 1.375(4) ?
C19 H19A . 0.9800 ?
C19 H19B . 0.9800 ?
C19 H19C . 0.9800 ?
C30 H30 . 0.9500 ?
C11 H11 . 0.9500 ?
C11 C12 . 1.392(3) ?
C3 H3 . 0.9500 ?
C8 H8 . 0.9500 ?
C8 C9 . 1.394(3) ?
C22 H22 . 0.9500 ?
C12 H12 . 0.9500 ?
C38 H38A . 0.9800 ?
C38 H38B . 0.9800 ?
C38 H38C . 0.9800 ?
C9 H9 . 0.9500 ?
C6 H6 . 0.9500 ?
C6 C5 . 1.388(3) ?
C5 H5 . 0.9500 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
N2 H1N O2 3_666 0.865(13) 2.004(13) 2.8634(18) 172.6(15)
C17 H17 O2 6_566 0.95 2.37 3.225(3) 149
C38 H38C O1 7_666 0.98 2.45 2.936(3) 110
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
Ag1 P1 C13 C18 . . . . 57.99(15) ?
Ag1 P1 C13 C14 . . . . -119.05(15) ?
Ag1 P1 C1 C2 . . . . 39.46(17) ?
Ag1 P1 C1 C6 . . . . -140.8(2) ?
Ag1 P1 C7 C8 . . . . -152.19(17) ?
Ag1 P1 C7 C12 . . . . 26.26(18) ?
Ag1 P2 C26 C27 . . . . 36.10(16) ?
Ag1 P2 C26 C31 . . . . -143.14(14) ?
Ag1 P2 C20 C25 . . . . -143.42(14) ?
Ag1 P2 C20 C21 . . . . 34.67(17) ?
Ag1 P2 C32 C33 . . . . -127.34(14) ?
Ag1 P2 C32 C37 . . . . 55.53(16) ?
Ag1 O2 N1 O1 . . . . 0.4(2) ?
Ag1 O1 N1 O2 . . . . -0.5(2) ?
P1 C13 C14 C15 . . . . 177.41(17) ?
P1 C1 C2 C3 . . . . 179.24(18) ?
P1 C1 C6 C5 . . . . -179.6(3) ?
P1 C7 C8 C9 . . . . -179.8(2) ?
P1 C7 C12 C11 . . . . -179.40(17) ?
P2 C26 C27 C28 . . . . 179.45(16) ?
P2 C26 C31 C30 . . . . 179.38(16) ?
P2 C20 C25 C24 . . . . 177.53(15) ?
P2 C20 C21 C22 . . . . -177.89(18) ?
P2 C32 C33 C34 . . . . -175.26(14) ?
P2 C32 C37 O4 . . . . -3.9(2) ?
P2 C32 C37 C36 . . . . 175.20(15) ?
O3 C18 C13 P1 . . . . 3.5(2) ?
O3 C18 C13 C14 . . . . -179.31(17) ?
O3 C18 C17 C16 . . . . 179.00(18) ?
O4 C37 C36 C35 . . . . 179.74(19) ?
C18 C13 C14 C15 . . . . 0.4(3) ?
C18 C17 C16 C15 . . . . 0.1(3) ?
C13 P1 C1 C2 . . . . -85.46(17) ?
C13 P1 C1 C6 . . . . 94.3(2) ?
C13 P1 C7 C8 . . . . -18.1(2) ?
C13 P1 C7 C12 . . . . 160.40(16) ?
C13 C18 C17 C16 . . . . -0.2(3) ?
C13 C14 C15 C16 . . . . -0.4(3) ?
C26 P2 C20 C25 . . . . -18.35(17) ?
C26 P2 C20 C21 . . . . 159.74(16) ?
C26 P2 C32 C33 . . . . 103.24(16) ?
C26 P2 C32 C37 . . . . -73.90(15) ?
C26 C27 C28 C29 . . . . 1.3(3) ?
C26 C31 C30 C29 . . . . 1.0(3) ?
C1 P1 C13 C18 . . . . 174.09(14) ?
C1 P1 C13 C14 . . . . -2.95(18) ?
C1 P1 C7 C8 . . . . 89.9(2) ?
C1 P1 C7 C12 . . . . -91.66(17) ?
C1 C2 C3 C4 . . . . 1.1(4) ?
C1 C6 C5 C4 . . . . -0.3(5) ?
C20 P2 C26 C27 . . . . -84.40(16) ?
C20 P2 C26 C31 . . . . 96.36(17) ?
C20 P2 C32 C33 . . . . -6.09(17) ?
C20 P2 C32 C37 . . . . 176.78(14) ?
C20 C25 C24 C23 . . . . 0.0(3) ?
C20 C21 C22 C23 . . . . 0.5(4) ?
C17 C18 C13 P1 . . . . -177.25(14) ?
C17 C18 C13 C14 . . . . -0.1(3) ?
C17 C16 C15 C14 . . . . 0.2(3) ?
C32 P2 C26 C27 . . . . 167.22(15) ?
C32 P2 C26 C31 . . . . -12.02(18) ?
C32 P2 C20 C25 . . . . 88.96(16) ?
C32 P2 C20 C21 . . . . -92.95(16) ?
C32 C37 C36 C35 . . . . 0.7(3) ?
C7 P1 C13 C18 . . . . -76.55(15) ?
C7 P1 C13 C14 . . . . 106.40(16) ?
C7 P1 C1 C2 . . . . 166.23(16) ?
C7 P1 C1 C6 . . . . -14.0(2) ?
C7 C8 C9 C10 . . . . -0.7(5) ?
C27 C26 C31 C30 . . . . 0.1(3) ?
C27 C28 C29 C30 . . . . -0.2(3) ?
C34 C35 C36 C37 . . . . 1.0(3) ?
C25 C20 C21 C22 . . . . 0.3(3) ?
C35 C34 C33 C32 . . . . -0.1(3) ?
C33 C32 C37 O4 . . . . 178.77(17) ?
C33 C32 C37 C36 . . . . -2.1(3) ?
C33 C34 C35 C36 . . . . -1.3(3) ?
C28 C29 C30 C31 . . . . -0.9(3) ?
C37 C32 C33 C34 . . . . 1.8(3) ?
C21 C20 C25 C24 . . . . -0.5(3) ?
C24 C23 C22 C21 . . . . -1.1(4) ?
C2 C1 C6 C5 . . . . 0.1(4) ?
C31 C26 C27 C28 . . . . -1.3(3) ?
C10 C11 C12 C7 . . . . -1.2(4) ?
C19 O3 C18 C13 . . . . -172.44(18) ?
C19 O3 C18 C17 . . . . 8.4(3) ?
C11 C10 C9 C8 . . . . -1.3(4) ?
C3 C4 C5 C6 . . . . 0.9(5) ?
C8 C7 C12 C11 . . . . -0.9(3) ?
C22 C23 C24 C25 . . . . 0.8(3) ?
C12 C7 C8 C9 . . . . 1.8(4) ?
C38 O4 C37 C32 . . . . 159.7(2) ?
C38 O4 C37 C36 . . . . -19.4(3) ?
C9 C10 C11 C12 . . . . 2.3(4) ?
C6 C1 C2 C3 . . . . -0.5(3) ?
C5 C4 C3 C2 . . . . -1.2(4) ?
