#------------------------------------------------------------------------------
#$Date: 2016-03-25 09:26:03 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179721 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/23/7002302.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_7002302
loop_
_publ_author_name
'Chai, Zuo-Yun'
'Wang, Zhong-Xia'
_publ_section_title
;
 Synthesis and characterization of Sn(II), Pb(II) and Yb(II) complexes
 supported by [C(Ph2PNSiMe3){6-(2-RC5H3N)}]2− or
 [CH(Ph2PNSiMe3){6-(2-RC5H3N)}]− (R =
 3,5-dimethyl-1-pyrazolyl or iminophosphoranyl) ligands
;
_journal_issue                   38
_journal_name_full               'Dalton Transactions'
_journal_page_first              8005
_journal_page_last               8012
_journal_paper_doi               10.1039/b906266a
_journal_year                    2009
_chemical_formula_sum            'C58 H72 N8 P2 Si2 Sn2'
_chemical_formula_weight         1236.74
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                100.983(2)
_cell_angle_beta                 108.444(2)
_cell_angle_gamma                91.686(2)
_cell_formula_units_Z            1
_cell_length_a                   9.9696(13)
_cell_length_b                   12.8011(17)
_cell_length_c                   12.8842(17)
_cell_measurement_reflns_used    4050
_cell_measurement_temperature    294(2)
_cell_measurement_theta_max      26.35
_cell_measurement_theta_min      2.71
_cell_volume                     1524.2(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      294(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0221
_diffrn_reflns_av_sigmaI/netI    0.0438
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       9
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            7769
_diffrn_reflns_theta_full        25.02
_diffrn_reflns_theta_max         25.02
_diffrn_reflns_theta_min         1.63
_exptl_absorpt_coefficient_mu    0.953
_exptl_absorpt_correction_T_max  1.000000
_exptl_absorpt_correction_T_min  0.700708
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_density_diffrn    1.347
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             634
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.484
_refine_diff_density_min         -0.276
_refine_diff_density_rms         0.066
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     330
_refine_ls_number_reflns         5337
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0451
_refine_ls_R_factor_gt           0.0318
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0390P)²+0.4151P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0735
_refine_ls_wR_factor_ref         0.0827
_reflns_number_gt                4411
_reflns_number_total             5337
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b906266a.txt
_cod_data_source_block           3
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'MULTI-SCAN' changed
to 'multi-scan' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from
2010-06-29.

'_refine_ls_hydrogen_treatment' value 'CONSTR' changed to
'constr' according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7002302
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Sn1 Sn 0.32992(2) 1.027306(18) 0.950857(19) 0.04029(9) Uani 1 1 d . . .
P1 P 0.45415(9) 0.92928(7) 0.78502(7) 0.0378(2) Uani 1 1 d . . .
Si1 Si 0.34430(11) 1.13734(8) 0.72073(8) 0.0487(2) Uani 1 1 d . . .
N1 N 0.4089(3) 1.0491(2) 0.8075(2) 0.0401(6) Uani 1 1 d . . .
N2 N 0.3351(3) 0.7657(2) 0.9698(2) 0.0436(7) Uani 1 1 d . . .
N3 N 0.2059(4) 0.6542(2) 1.0348(3) 0.0583(8) Uani 1 1 d . . .
N4 N 0.2261(4) 0.5789(3) 1.1002(3) 0.0669(9) Uani 1 1 d . . .
C1 C 0.4600(3) 0.8920(2) 0.9089(3) 0.0387(7) Uani 1 1 d . . .
C2 C 0.4304(4) 0.7813(3) 0.9177(3) 0.0415(8) Uani 1 1 d . . .
C3 C 0.4986(4) 0.6958(3) 0.8788(3) 0.0534(9) Uani 1 1 d . . .
H3 H 0.5677 0.7076 0.8468 0.064 Uiso 1 1 calc R . .
C4 C 0.4626(5) 0.5941(3) 0.8882(3) 0.0634(11) Uani 1 1 d . . .
H4 H 0.5062 0.5367 0.8614 0.076 Uiso 1 1 calc R . .
C5 C 0.3624(5) 0.5776(3) 0.9374(3) 0.0601(10) Uani 1 1 d . . .
H5 H 0.3345 0.5094 0.9427 0.072 Uiso 1 1 calc R . .
C6 C 0.3046(4) 0.6661(3) 0.9787(3) 0.0483(9) Uani 1 1 d . . .
C7 C 0.0295(5) 0.7812(4) 0.9592(5) 0.0836(14) Uani 1 1 d . . .
H7A H 0.0877 0.8480 0.9903 0.125 Uiso 1 1 calc R . .
H7B H -0.0664 0.7919 0.9563 0.125 Uiso 1 1 calc R . .
H7C H 0.0315 0.7541 0.8849 0.125 Uiso 1 1 calc R . .
C8 C 0.0849(5) 0.7030(3) 1.0305(4) 0.0654(11) Uani 1 1 d . . .
C9 C 0.0286(5) 0.6575(4) 1.0974(4) 0.0793(14) Uani 1 1 d . . .
H9 H -0.0544 0.6738 1.1127 0.095 Uiso 1 1 calc R . .
C10 C 0.1174(6) 0.5825(4) 1.1384(4) 0.0736(13) Uani 1 1 d . . .
C11 C 0.1018(7) 0.5097(4) 1.2131(5) 0.108(2) Uani 1 1 d . . .
H11A H 0.1431 0.4447 1.1957 0.163 Uiso 1 1 d R . .
H11B H 0.0028 0.4937 1.2016 0.163 Uiso 1 1 d R . .
H11C H 0.1494 0.5443 1.2898 0.163 Uiso 1 1 d R . .
C12 C 0.3253(4) 0.8420(3) 0.6630(3) 0.0449(8) Uani 1 1 d . . .
C13 C 0.3302(4) 0.8360(3) 0.5558(3) 0.0610(10) Uani 1 1 d . . .
H13 H 0.4063 0.8714 0.5454 0.073 Uiso 1 1 calc R . .
C14 C 0.2233(5) 0.7779(4) 0.4642(3) 0.0754(13) Uani 1 1 d . . .
H14 H 0.2280 0.7739 0.3926 0.090 Uiso 1 1 calc R . .
C15 C 0.1107(5) 0.7264(4) 0.4784(4) 0.0755(14) Uani 1 1 d . . .
H15 H 0.0386 0.6876 0.4164 0.091 Uiso 1 1 calc R . .
C16 C 0.1034(4) 0.7315(4) 0.5836(4) 0.0704(12) Uani 1 1 d . . .
H16 H 0.0268 0.6957 0.5927 0.085 Uiso 1 1 calc R . .
C17 C 0.2095(4) 0.7898(3) 0.6769(3) 0.0541(9) Uani 1 1 d . . .
H17 H 0.2034 0.7939 0.7481 0.065 Uiso 1 1 calc R . .
C18 C 0.6199(3) 0.9270(3) 0.7539(3) 0.0421(8) Uani 1 1 d . . .
C19 C 0.7136(4) 1.0189(3) 0.7906(3) 0.0542(9) Uani 1 1 d . . .
H19 H 0.6892 1.0816 0.8270 0.065 Uiso 1 1 calc R . .
C20 C 0.8437(4) 1.0172(4) 0.7729(4) 0.0690(12) Uani 1 1 d . . .
H20 H 0.9057 1.0792 0.7968 0.083 Uiso 1 1 calc R . .
C21 C 0.8818(5) 0.9248(4) 0.7205(4) 0.0761(13) Uani 1 1 d . . .
H21 H 0.9693 0.9242 0.7091 0.091 Uiso 1 1 calc R . .
C22 C 0.7903(5) 0.8331(4) 0.6848(4) 0.0712(12) Uani 1 1 d . . .
H22 H 0.8160 0.7704 0.6493 0.085 Uiso 1 1 calc R . .
C23 C 0.6598(4) 0.8337(3) 0.7017(3) 0.0546(9) Uani 1 1 d . . .
H23 H 0.5986 0.7713 0.6780 0.066 Uiso 1 1 calc R . .
C24 C 0.1666(6) 1.0863(4) 0.6188(5) 0.114(2) Uani 1 1 d . . .
H24A H 0.1717 1.0175 0.5755 0.171 Uiso 1 1 calc R . .
H24B H 0.1354 1.1351 0.5699 0.171 Uiso 1 1 calc R . .
H24C H 0.1005 1.0797 0.6581 0.171 Uiso 1 1 calc R . .
C25 C 0.4636(7) 1.1641(6) 0.6424(6) 0.134(3) Uani 1 1 d . . .
H25A H 0.5537 1.1972 0.6941 0.200 Uiso 1 1 calc R . .
H25B H 0.4220 1.2109 0.5935 0.200 Uiso 1 1 calc R . .
H25C H 0.4771 1.0980 0.5989 0.200 Uiso 1 1 calc R . .
C26 C 0.3265(7) 1.2640(4) 0.8095(4) 0.0963(18) Uani 1 1 d . . .
H26A H 0.2767 1.2492 0.8587 0.144 Uiso 1 1 calc R . .
H26B H 0.2743 1.3094 0.7630 0.144 Uiso 1 1 calc R . .
H26C H 0.4191 1.2991 0.8531 0.144 Uiso 1 1 calc R . .
C27 C 0.2404(9) 0.4556(6) 0.5815(7) 0.148(3) Uani 1 1 d D . .
H27A H 0.1671 0.4628 0.5146 0.221 Uiso 1 1 calc R . .
H27B H 0.2164 0.4890 0.6457 0.221 Uiso 1 1 calc R . .
H27C H 0.2492 0.3811 0.5818 0.221 Uiso 1 1 calc R . .
C28 C 0.3764(10) 0.5075(7) 0.5854(8) 0.178(4) Uani 1 1 d D . .
H28A H 0.3655 0.5827 0.5865 0.213 Uiso 1 1 calc R . .
H28B H 0.4474 0.5029 0.6556 0.213 Uiso 1 1 calc R . .
C29 C 0.4308(9) 0.4664(7) 0.4966(8) 0.169(4) Uani 1 1 d D . .
H29A H 0.3583 0.4657 0.4254 0.203 Uiso 1 1 calc R . .
H29B H 0.4514 0.3932 0.4992 0.203 Uiso 1 1 calc R . .
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'
N N 0.0061 0.0033 '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'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sn Sn -0.6537 1.4246 '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 Sn1 N1 68.86(10) . . ?
C1 Sn1 C1 86.36(11) . 2_677 ?
N1 Sn1 C1 94.29(10) . 2_677 ?
C1 Sn1 P1 36.72(8) . . ?
N1 Sn1 P1 33.60(7) . . ?
C1 Sn1 P1 98.14(8) 2_677 . ?
N1 P1 C1 100.75(14) . . ?
N1 P1 C18 111.48(15) . . ?
C1 P1 C18 115.53(15) . . ?
N1 P1 C12 112.60(15) . . ?
C1 P1 C12 112.13(17) . . ?
C18 P1 C12 104.66(15) . . ?
N1 P1 Sn1 51.64(10) . . ?
C1 P1 Sn1 51.72(10) . . ?
C18 P1 Sn1 142.17(11) . . ?
C12 P1 Sn1 113.11(11) . . ?
N1 Si1 C26 107.65(18) . . ?
N1 Si1 C25 112.4(2) . . ?
C26 Si1 C25 109.1(3) . . ?
N1 Si1 C24 111.3(2) . . ?
C26 Si1 C24 107.9(3) . . ?
C25 Si1 C24 108.3(3) . . ?
P1 N1 Si1 133.03(17) . . ?
P1 N1 Sn1 94.77(12) . . ?
Si1 N1 Sn1 123.97(13) . . ?
C6 N2 C2 117.9(3) . . ?
C8 N3 N4 112.4(3) . . ?
C8 N3 C6 129.8(4) . . ?
N4 N3 C6 117.7(3) . . ?
C10 N4 N3 104.7(4) . . ?
C2 C1 P1 123.9(2) . . ?
C2 C1 Sn1 123.4(2) . . ?
P1 C1 Sn1 91.56(13) . . ?
C2 C1 Sn1 110.7(2) . 2_677 ?
P1 C1 Sn1 108.67(16) . 2_677 ?
Sn1 C1 Sn1 93.64(11) . 2_677 ?
N2 C2 C3 120.5(3) . . ?
N2 C2 C1 116.2(3) . . ?
C3 C2 C1 123.2(3) . . ?
C4 C3 C2 119.6(4) . . ?
C4 C3 H3 120.2 . . ?
C2 C3 H3 120.2 . . ?
C5 C4 C3 119.8(4) . . ?
C5 C4 H4 120.1 . . ?
C3 C4 H4 120.1 . . ?
C4 C5 C6 117.4(4) . . ?
C4 C5 H5 121.3 . . ?
C6 C5 H5 121.3 . . ?
N2 C6 C5 124.5(4) . . ?
N2 C6 N3 115.8(3) . . ?
C5 C6 N3 119.7(3) . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C8 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
N3 C8 C9 104.4(4) . . ?
N3 C8 C7 124.4(4) . . ?
C9 C8 C7 131.0(4) . . ?
C8 C9 C10 107.9(4) . . ?
C8 C9 H9 126.0 . . ?
C10 C9 H9 126.0 . . ?
N4 C10 C9 110.6(4) . . ?
N4 C10 C11 120.4(5) . . ?
C9 C10 C11 129.0(5) . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C13 C12 C17 118.9(3) . . ?
C13 C12 P1 122.0(3) . . ?
C17 C12 P1 118.7(3) . . ?
C14 C13 C12 120.6(4) . . ?
C14 C13 H13 119.7 . . ?
C12 C13 H13 119.7 . . ?
C15 C14 C13 120.1(4) . . ?
C15 C14 H14 119.9 . . ?
C13 C14 H14 119.9 . . ?
C14 C15 C16 120.2(4) . . ?
C14 C15 H15 119.9 . . ?
C16 C15 H15 119.9 . . ?
C15 C16 C17 120.6(4) . . ?
C15 C16 H16 119.7 . . ?
C17 C16 H16 119.7 . . ?
C16 C17 C12 119.5(4) . . ?
C16 C17 H17 120.3 . . ?
C12 C17 H17 120.3 . . ?
C19 C18 C23 119.0(3) . . ?
C19 C18 P1 119.1(3) . . ?
C23 C18 P1 121.7(3) . . ?
C20 C19 C18 120.0(4) . . ?
C20 C19 H19 120.0 . . ?
C18 C19 H19 120.0 . . ?
C21 C20 C19 120.6(4) . . ?
C21 C20 H20 119.7 . . ?
C19 C20 H20 119.7 . . ?
C20 C21 C22 119.8(4) . . ?
C20 C21 H21 120.1 . . ?
C22 C21 H21 120.1 . . ?
C21 C22 C23 120.2(4) . . ?
C21 C22 H22 119.9 . . ?
C23 C22 H22 119.9 . . ?
C22 C23 C18 120.4(4) . . ?
C22 C23 H23 119.8 . . ?
C18 C23 H23 119.8 . . ?
Si1 C24 H24A 109.5 . . ?
Si1 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
Si1 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
Si1 C25 H25A 109.5 . . ?
Si1 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
Si1 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
Si1 C26 H26A 109.5 . . ?
Si1 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
Si1 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C28 C27 H27A 109.5 . . ?
C28 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C28 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C29 C28 C27 117.3(8) . . ?
C29 C28 H28A 108.0 . . ?
C27 C28 H28A 108.0 . . ?
C29 C28 H28B 108.0 . . ?
C27 C28 H28B 108.0 . . ?
H28A C28 H28B 107.2 . . ?
C28 C29 C29 113.1(9) . 2_666 ?
C28 C29 H29A 109.0 . . ?
C29 C29 H29A 109.0 2_666 . ?
C28 C29 H29B 109.0 . . ?
C29 C29 H29B 109.0 2_666 . ?
H29A C29 H29B 107.8 . . ?
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
Sn1 C1 2.278(3) . ?
Sn1 N1 2.283(3) . ?
Sn1 C1 2.342(3) 2_677 ?
Sn1 P1 2.9014(9) . ?
P1 N1 1.611(3) . ?
P1 C1 1.735(3) . ?
P1 C18 1.819(3) . ?
P1 C12 1.827(3) . ?
Si1 N1 1.734(3) . ?
Si1 C26 1.846(4) . ?
Si1 C25 1.849(5) . ?
Si1 C24 1.850(5) . ?
N2 C6 1.336(4) . ?
N2 C2 1.355(4) . ?
N3 C8 1.365(5) . ?
N3 N4 1.376(4) . ?
N3 C6 1.414(5) . ?
N4 C10 1.322(6) . ?
C1 C2 1.472(5) . ?
C1 Sn1 2.342(3) 2_677 ?
C2 C3 1.400(4) . ?
C3 C4 1.379(5) . ?
C3 H3 0.9300 . ?
C4 C5 1.372(6) . ?
C4 H4 0.9300 . ?
C5 C6 1.378(5) . ?
C5 H5 0.9300 . ?
C7 C8 1.487(6) . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C8 C9 1.370(6) . ?
C9 C10 1.390(7) . ?
C9 H9 0.9300 . ?
C10 C11 1.499(7) . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 C13 1.385(5) . ?
C12 C17 1.394(5) . ?
C13 C14 1.380(6) . ?
C13 H13 0.9300 . ?
C14 C15 1.365(6) . ?
C14 H14 0.9300 . ?
C15 C16 1.370(6) . ?
C15 H15 0.9300 . ?
C16 C17 1.388(5) . ?
C16 H16 0.9300 . ?
C17 H17 0.9300 . ?
C18 C19 1.388(5) . ?
C18 C23 1.388(5) . ?
C19 C20 1.385(5) . ?
C19 H19 0.9300 . ?
C20 C21 1.373(6) . ?
C20 H20 0.9300 . ?
C21 C22 1.374(6) . ?
C21 H21 0.9300 . ?
C22 C23 1.385(5) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C27 C28 1.474(7) . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C28 C29 1.435(8) . ?
C28 H28A 0.9700 . ?
C28 H28B 0.9700 . ?
C29 C29 1.574(16) 2_666 ?
C29 H29A 0.9700 . ?
C29 H29B 0.9700 . ?
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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C1 Sn1 P1 N1 -158.09(19) . . . . ?
C1 Sn1 P1 N1 -85.49(15) 2_677 . . . ?
N1 Sn1 P1 C1 158.09(19) . . . . ?
C1 Sn1 P1 C1 72.60(18) 2_677 . . . ?
C1 Sn1 P1 C18 -83.0(2) . . . . ?
N1 Sn1 P1 C18 75.1(2) . . . . ?
C1 Sn1 P1 C18 -10.4(2) 2_677 . . . ?
C1 Sn1 P1 C12 100.66(19) . . . . ?
N1 Sn1 P1 C12 -101.25(18) . . . . ?
C1 Sn1 P1 C12 173.26(15) 2_677 . . . ?
C1 P1 N1 Si1 -165.0(2) . . . . ?
C18 P1 N1 Si1 71.9(3) . . . . ?
C12 P1 N1 Si1 -45.4(3) . . . . ?
Sn1 P1 N1 Si1 -147.7(3) . . . . ?
C1 P1 N1 Sn1 -17.34(15) . . . . ?
C18 P1 N1 Sn1 -140.44(12) . . . . ?
C12 P1 N1 Sn1 102.28(15) . . . . ?
C26 Si1 N1 P1 -176.9(3) . . . . ?
C25 Si1 N1 P1 -56.7(4) . . . . ?
C24 Si1 N1 P1 65.0(3) . . . . ?
C26 Si1 N1 Sn1 43.1(3) . . . . ?
C25 Si1 N1 Sn1 163.3(3) . . . . ?
C24 Si1 N1 Sn1 -75.0(3) . . . . ?
C1 Sn1 N1 P1 13.84(12) . . . . ?
C1 Sn1 N1 P1 98.26(13) 2_677 . . . ?
C1 Sn1 N1 Si1 165.7(2) . . . . ?
C1 Sn1 N1 Si1 -109.89(17) 2_677 . . . ?
P1 Sn1 N1 Si1 151.9(3) . . . . ?
C8 N3 N4 C10 -1.1(5) . . . . ?
C6 N3 N4 C10 -177.8(3) . . . . ?
N1 P1 C1 C2 150.3(3) . . . . ?
C18 P1 C1 C2 -89.5(3) . . . . ?
C12 P1 C1 C2 30.3(3) . . . . ?
Sn1 P1 C1 C2 133.0(3) . . . . ?
N1 P1 C1 Sn1 17.32(15) . . . . ?
C18 P1 C1 Sn1 137.57(14) . . . . ?
C12 P1 C1 Sn1 -102.64(15) . . . . ?
N1 P1 C1 Sn1 -77.05(16) . . . 2_677 ?
C18 P1 C1 Sn1 43.2(2) . . . 2_677 ?
C12 P1 C1 Sn1 162.99(14) . . . 2_677 ?
Sn1 P1 C1 Sn1 -94.37(15) . . . 2_677 ?
N1 Sn1 C1 C2 -146.2(3) . . . . ?
C1 Sn1 C1 C2 117.8(3) 2_677 . . . ?
P1 Sn1 C1 C2 -133.4(3) . . . . ?
N1 Sn1 C1 P1 -12.79(11) . . . . ?
C1 Sn1 C1 P1 -108.82(16) 2_677 . . . ?
N1 Sn1 C1 Sn1 96.03(12) . . . 2_677 ?
C1 Sn1 C1 Sn1 -0.002(2) 2_677 . . 2_677 ?
P1 Sn1 C1 Sn1 108.82(16) . . . 2_677 ?
C6 N2 C2 C3 -2.5(5) . . . . ?
C6 N2 C2 C1 179.5(3) . . . . ?
P1 C1 C2 N2 -129.2(3) . . . . ?
Sn1 C1 C2 N2 -10.4(4) . . . . ?
Sn1 C1 C2 N2 98.9(3) 2_677 . . . ?
P1 C1 C2 C3 52.9(4) . . . . ?
Sn1 C1 C2 C3 171.7(3) . . . . ?
Sn1 C1 C2 C3 -79.0(3) 2_677 . . . ?
N2 C2 C3 C4 3.5(5) . . . . ?
C1 C2 C3 C4 -178.7(3) . . . . ?
C2 C3 C4 C5 -1.2(6) . . . . ?
C3 C4 C5 C6 -1.9(6) . . . . ?
C2 N2 C6 C5 -0.7(5) . . . . ?
C2 N2 C6 N3 179.3(3) . . . . ?
C4 C5 C6 N2 3.0(6) . . . . ?
C4 C5 C6 N3 -177.0(4) . . . . ?
C8 N3 C6 N2 39.6(5) . . . . ?
N4 N3 C6 N2 -144.3(3) . . . . ?
C8 N3 C6 C5 -140.4(4) . . . . ?
N4 N3 C6 C5 35.7(5) . . . . ?
N4 N3 C8 C9 1.0(5) . . . . ?
C6 N3 C8 C9 177.2(4) . . . . ?
N4 N3 C8 C7 -174.8(4) . . . . ?
C6 N3 C8 C7 1.4(7) . . . . ?
N3 C8 C9 C10 -0.5(5) . . . . ?
C7 C8 C9 C10 174.9(5) . . . . ?
N3 N4 C10 C9 0.7(5) . . . . ?
N3 N4 C10 C11 179.4(4) . . . . ?
C8 C9 C10 N4 -0.1(5) . . . . ?
C8 C9 C10 C11 -178.7(5) . . . . ?
N1 P1 C12 C13 86.2(3) . . . . ?
C1 P1 C12 C13 -161.0(3) . . . . ?
C18 P1 C12 C13 -35.1(3) . . . . ?
Sn1 P1 C12 C13 142.6(3) . . . . ?
N1 P1 C12 C17 -86.2(3) . . . . ?
C1 P1 C12 C17 26.6(3) . . . . ?
C18 P1 C12 C17 152.5(3) . . . . ?
Sn1 P1 C12 C17 -29.8(3) . . . . ?
C17 C12 C13 C14 -0.9(6) . . . . ?
P1 C12 C13 C14 -173.3(3) . . . . ?
C12 C13 C14 C15 0.5(7) . . . . ?
C13 C14 C15 C16 -0.3(7) . . . . ?
C14 C15 C16 C17 0.6(7) . . . . ?
C15 C16 C17 C12 -1.0(6) . . . . ?
C13 C12 C17 C16 1.1(6) . . . . ?
P1 C12 C17 C16 173.8(3) . . . . ?
N1 P1 C18 C19 23.2(3) . . . . ?
C1 P1 C18 C19 -91.0(3) . . . . ?
C12 P1 C18 C19 145.2(3) . . . . ?
Sn1 P1 C18 C19 -31.3(4) . . . . ?
N1 P1 C18 C23 -161.6(3) . . . . ?
C1 P1 C18 C23 84.2(3) . . . . ?
C12 P1 C18 C23 -39.6(3) . . . . ?
Sn1 P1 C18 C23 143.9(2) . . . . ?
C23 C18 C19 C20 1.3(6) . . . . ?
P1 C18 C19 C20 176.6(3) . . . . ?
C18 C19 C20 C21 -0.8(6) . . . . ?
C19 C20 C21 C22 0.1(7) . . . . ?
C20 C21 C22 C23 0.0(7) . . . . ?
C21 C22 C23 C18 0.5(6) . . . . ?
C19 C18 C23 C22 -1.1(5) . . . . ?
P1 C18 C23 C22 -176.3(3) . . . . ?
C27 C28 C29 C29 175.1(10) . . . 2_666 ?
