#------------------------------------------------------------------------------
#$Date: 2016-03-05 04:34:58 +0200 (Sat, 05 Mar 2016) $
#$Revision: 177601 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/27/1542727.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_1542727
loop_
_publ_author_name
'Li, Yun-Hua'
'Shao, Yong-Liang'
_publ_section_title
;
 μ-Chlorido-bis[(dimethyl
 sulfoxide-κO)bis(triphenylphosphane-κP)silver(I)] nitrate
;
_journal_coeditor_code           WM4005
_journal_issue                   3
_journal_name_full               IUCrData
_journal_page_first              x160332
_journal_paper_doi               10.1107/S2414314616003321
_journal_volume                  1
_journal_year                    2016
_chemical_formula_iupac          '[Ag2 Cl (C2 H6 O S)2 (C18 H15 P)4] N O3'
_chemical_formula_moiety         'C76 H72 Ag2 Cl O2 P4 S2 +, N O3 -'
_chemical_formula_sum            'C76 H72 Ag2 Cl N O5 P4 S2'
_chemical_formula_weight         1518.56
_chemical_name_systematic
;
μ-Chlorido-bis[(dimethyl
sulfoxide-κO)bis(triphenylphosphane-κP)silver(I)] nitrate
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_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
;
Olex2 1.2
(compiled 2015.09.30 svn.r3233 for OlexSys, GUI svn.r5103)
;
_cell_angle_alpha                93.489(5)
_cell_angle_beta                 117.157(4)
_cell_angle_gamma                115.354(4)
_cell_formula_units_Z            1
_cell_length_a                   12.440(3)
_cell_length_b                   13.070(3)
_cell_length_c                   13.579(3)
_cell_measurement_reflns_used    4355
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      28.35
_cell_measurement_theta_min      2.25
_cell_volume                     1682.6(7)
_computing_cell_refinement
;
CrysAlis PRO (Agilent, 2014)
;
_computing_data_collection
;
CrysAlis PRO (Agilent, 2014)
;
_computing_data_reduction
;
CrysAlis PRO (Agilent, 2014)
;
_computing_molecular_graphics
;
Mercury (Macrae et al.,  2006)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
OLEX2 (Dolomanov et al.,  2009)
;
_computing_structure_solution
;
SHELXS97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Agilent CCD Xcalibur'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0615
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            8521
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.78
_exptl_absorpt_coefficient_mu    0.832
_exptl_absorpt_correction_T_max  0.905
_exptl_absorpt_correction_T_min  0.861
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(CrysAlis PRO; Agilent, 2014)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.499
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             778
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.12
_refine_diff_density_max         2.388
_refine_diff_density_min         -2.115
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.123
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     430
_refine_ls_number_reflns         5868
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.122
_refine_ls_R_factor_all          0.0707
_refine_ls_R_factor_gt           0.0639
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0478P)²+6.8934P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1477
_refine_ls_wR_factor_ref         0.1528
_reflns_number_gt                5298
_reflns_number_total             5941
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            wm4005sup1.cif
_cod_data_source_block           I
_cod_database_code               1542727
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, -y, -z'
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 0.04619(4) 0.07560(4) 0.71100(4) 0.03575(17) Uani d 1 . .
Cl Cl1 0.0000 0.0000 0.5000 0.0484(6) Uani d 1 . .
S S1 -0.26857(16) -0.19692(13) 0.61116(14) 0.0371(4) Uani d 1 . .
P P1 0.03902(14) 0.25182(12) 0.76647(13) 0.0288(3) Uani d 1 . .
P P2 0.23582(14) 0.03943(12) 0.82202(12) 0.0251(3) Uani d 1 . .
O O4 -0.1809(5) -0.0643(3) 0.6687(4) 0.0434(11) Uani d 1 . .
C C1 -0.2383(6) 0.1576(5) 0.5935(5) 0.0388(14) Uani d 1 . .
H H1 -0.2448 0.0841 0.5942 0.047 Uiso calc 1 . .
C C2 -0.3545(6) 0.1622(6) 0.5162(6) 0.0492(17) Uani d 1 . .
H H2 -0.4390 0.0920 0.4639 0.059 Uiso calc 1 . .
C C3 -0.3452(7) 0.2706(6) 0.5167(6) 0.0474(17) Uani d 1 . .
H H3 -0.4243 0.2733 0.4649 0.057 Uiso calc 1 . .
C C4 -0.2228(7) 0.3735(6) 0.5912(6) 0.0419(15) Uani d 1 . .
H H4 -0.2178 0.4466 0.5910 0.050 Uiso calc 1 . .
C C5 -0.1055(6) 0.3694(5) 0.6674(5) 0.0360(14) Uani d 1 . .
H H5 -0.0208 0.4402 0.7179 0.043 Uiso calc 1 . .
C C6 -0.1124(6) 0.2614(5) 0.6697(5) 0.0311(12) Uani d 1 . .
C C7 -0.0046(7) 0.3372(6) 0.9310(6) 0.0418(15) Uani d 1 . .
H H7 -0.0751 0.3426 0.8695 0.050 Uiso calc 1 . .
C C8 0.0251(8) 0.3725(6) 1.0423(7) 0.0527(18) Uani d 1 . .
H H8 -0.0258 0.4005 1.0557 0.063 Uiso calc 1 . .
C C9 0.1299(8) 0.3659(6) 1.1330(6) 0.0483(17) Uani d 1 . .
H H9 0.1520 0.3915 1.2087 0.058 Uiso calc 1 . .
C C10 0.2021(8) 0.3221(6) 1.1131(6) 0.0500(17) Uani d 1 . .
H H10 0.2733 0.3177 1.1750 0.060 Uiso calc 1 . .
C C11 0.1699(7) 0.2845(6) 1.0020(6) 0.0434(15) Uani d 1 . .
H H11 0.2172 0.2519 0.9885 0.052 Uiso calc 1 . .
C C12 0.0678(6) 0.2942(5) 0.9094(5) 0.0326(13) Uani d 1 . .
C C13 0.2916(6) 0.4746(5) 0.8694(5) 0.0322(13) Uani d 1 . .
H H13 0.2912 0.4803 0.9378 0.039 Uiso calc 1 . .
C C14 0.4001(6) 0.5616(5) 0.8674(5) 0.0393(14) Uani d 1 . .
H H14 0.4735 0.6262 0.9346 0.047 Uiso calc 1 . .
C C15 0.4027(7) 0.5555(6) 0.7684(6) 0.0423(15) Uani d 1 . .
H H15 0.4777 0.6157 0.7681 0.051 Uiso calc 1 . .
C C16 0.2943(7) 0.4603(6) 0.6687(6) 0.0402(15) Uani d 1 . .
H H16 0.2947 0.4559 0.6002 0.048 Uiso calc 1 . .
C C17 0.1862(6) 0.3723(5) 0.6717(5) 0.0331(13) Uani d 1 . .
H H17 0.1135 0.3070 0.6050 0.040 Uiso calc 1 . .
C C18 0.1828(5) 0.3786(5) 0.7719(5) 0.0271(12) Uani d 1 . .
C C19 0.1706(6) 0.0051(5) 0.9879(5) 0.0352(13) Uani d 1 . .
H H19 0.0783 -0.0339 0.9242 0.042 Uiso calc 1 . .
C C20 0.1975(7) 0.0112(5) 1.0988(6) 0.0385(14) Uani d 1 . .
H H20 0.1235 -0.0256 1.1104 0.046 Uiso calc 1 . .
C C21 0.3331(7) 0.0716(5) 1.1915(5) 0.0353(13) Uani d 1 . .
H H21 0.3512 0.0756 1.2665 0.042 Uiso calc 1 . .
C C22 0.4416(6) 0.1257(5) 1.1763(5) 0.0352(14) Uani d 1 . .
H H22 0.5335 0.1680 1.2407 0.042 Uiso calc 1 . .
C C23 0.4167(6) 0.1187(5) 1.0660(5) 0.0283(12) Uani d 1 . .
H H23 0.4915 0.1555 1.0554 0.034 Uiso calc 1 . .
C C24 0.2808(5) 0.0571(4) 0.9716(4) 0.0241(11) Uani d 1 . .
C C25 0.4200(6) 0.2558(5) 0.8256(5) 0.0308(12) Uani d 1 . .
H H25 0.3540 0.2763 0.8173 0.037 Uiso calc 1 . .
C C26 0.5389(6) 0.3362(5) 0.8317(5) 0.0373(14) Uani d 1 . .
H H26 0.5541 0.4117 0.8285 0.045 Uiso calc 1 . .
C C27 0.6363(7) 0.3075(5) 0.8425(5) 0.0391(14) Uani d 1 . .
H H27 0.7175 0.3628 0.8467 0.047 Uiso calc 1 . .
C C28 0.6125(7) 0.1958(6) 0.8472(6) 0.0439(16) Uani d 1 . .
H H28 0.6779 0.1753 0.8538 0.053 Uiso calc 1 . .
C C29 0.4949(6) 0.1148(5) 0.8422(6) 0.0379(14) Uani d 1 . .
H H29 0.4805 0.0396 0.8459 0.046 Uiso calc 1 . .
C C30 0.3966(6) 0.1437(5) 0.8317(4) 0.0256(11) Uani d 1 . .
C C31 0.2194(6) -0.1782(5) 0.8462(5) 0.0313(12) Uani d 1 . .
H H31 0.2412 -0.1516 0.9216 0.038 Uiso calc 1 . .
C C32 0.1942(7) -0.2895(5) 0.8046(6) 0.0395(14) Uani d 1 . .
H H32 0.1992 -0.3379 0.8519 0.047 Uiso calc 1 . .
C C33 0.1624(6) -0.3291(5) 0.6954(6) 0.0377(14) Uani d 1 . .
H H33 0.1449 -0.4048 0.6677 0.045 Uiso calc 1 . .
C C34 0.1555(6) -0.2580(5) 0.6247(5) 0.0341(13) Uani d 1 . .
H H34 0.1343 -0.2854 0.5497 0.041 Uiso calc 1 . .
C C35 0.1797(6) -0.1470(5) 0.6648(5) 0.0315(12) Uani d 1 . .
H H35 0.1741 -0.0993 0.6168 0.038 Uiso calc 1 . .
C C36 0.2125(5) -0.1056(4) 0.7768(5) 0.0264(11) Uani d 1 . .
C C37 -0.3516(8) -0.2205(7) 0.4597(6) 0.0544(19) Uani d 1 . .
H H37A -0.4095 -0.3048 0.4185 0.082 Uiso calc 1 . .
H H37B -0.2815 -0.1847 0.4404 0.082 Uiso calc 1 . .
H H37C -0.4091 -0.1851 0.4375 0.082 Uiso calc 1 . .
C C38 -0.1502(7) -0.2429(6) 0.6253(6) 0.0446(16) Uani d 1 . .
H H38A -0.2008 -0.3279 0.5897 0.067 Uiso calc 1 . .
H H38B -0.0821 -0.2220 0.7065 0.067 Uiso calc 1 . .
H H38C -0.1029 -0.2040 0.5873 0.067 Uiso calc 1 . .
N N1 0.511(4) 0.506(6) 0.5173(15) 0.035(3) Uani d 0.50 A -1
O O1 0.5480(17) 0.4748(12) 0.4527(14) 0.070(3) Uani d 0.50 A -1
O O2 0.4006(13) 0.5016(13) 0.4696(13) 0.063(3) Uani d 0.50 A -1
O O3 0.5750(14) 0.5105(11) 0.6173(10) 0.082(3) Uani d 0.50 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 0.0030 0.0020 '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 -0.8970 1.1010 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1480 0.1590 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0060 0.0030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0110 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1020 0.0940 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1250 0.1230 '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
P1 Ag1 Cl1 . 120.71(4)
P2 Ag1 Cl1 . 97.42(4)
P2 Ag1 P1 . 125.89(5)
O4 Ag1 Cl1 . 96.95(11)
O4 Ag1 P1 . 95.62(11)
O4 Ag1 P2 . 117.80(12)
Ag1 Cl1 Ag1 2_556 180.0
O4 S1 C37 . 106.2(3)
O4 S1 C38 . 105.7(3)
C38 S1 C37 . 97.4(4)
C6 P1 Ag1 . 118.66(19)
C6 P1 C12 . 104.4(3)
C6 P1 C18 . 103.3(3)
C12 P1 Ag1 . 117.58(19)
C12 P1 C18 . 103.6(3)
C18 P1 Ag1 . 107.40(18)
C24 P2 Ag1 . 111.65(17)
C30 P2 Ag1 . 112.26(17)
C30 P2 C24 . 105.6(2)
C36 P2 Ag1 . 119.52(17)
C36 P2 C24 . 102.2(2)
C36 P2 C30 . 104.3(2)
S1 O4 Ag1 . 130.5(2)
C2 C1 H1 . 119.9
C2 C1 C6 . 120.2(6)
C6 C1 H1 . 119.9
C1 C2 H2 . 120.1
C3 C2 C1 . 119.8(6)
C3 C2 H2 . 120.1
C2 C3 H3 . 119.5
C4 C3 C2 . 121.0(6)
C4 C3 H3 . 119.5
C3 C4 H4 . 120.3
C3 C4 C5 . 119.5(6)
C5 C4 H4 . 120.3
C4 C5 H5 . 119.6
C4 C5 C6 . 120.7(6)
C6 C5 H5 . 119.6
C1 C6 P1 . 118.9(4)
C1 C6 C5 . 118.9(5)
C5 C6 P1 . 122.2(4)
C8 C7 H7 . 119.4
C12 C7 H7 . 119.4
C12 C7 C8 . 121.1(6)
C7 C8 H8 . 120.2
C9 C8 C7 . 119.5(7)
C9 C8 H8 . 120.2
C8 C9 H9 . 119.9
C10 C9 C8 . 120.3(7)
C10 C9 H9 . 119.9
C9 C10 H10 . 120.0
C9 C10 C11 . 120.0(7)
C11 C10 H10 . 120.0
C10 C11 H11 . 119.6
C10 C11 C12 . 120.8(6)
C12 C11 H11 . 119.6
C7 C12 P1 . 123.4(5)
C7 C12 C11 . 118.3(6)
C11 C12 P1 . 118.2(5)
C14 C13 H13 . 119.7
C14 C13 C18 . 120.7(6)
C18 C13 H13 . 119.7
C13 C14 H14 . 119.6
C13 C14 C15 . 120.8(6)
C15 C14 H14 . 119.6
C14 C15 H15 . 120.1
C14 C15 C16 . 119.9(6)
C16 C15 H15 . 120.1
C15 C16 H16 . 120.5
C17 C16 C15 . 119.0(6)
C17 C16 H16 . 120.5
C16 C17 H17 . 119.4
C16 C17 C18 . 121.2(5)
C18 C17 H17 . 119.4
C13 C18 P1 . 124.8(5)
C13 C18 C17 . 118.4(5)
C17 C18 P1 . 116.6(4)
C20 C19 H19 . 120.2
C24 C19 H19 . 120.2
C24 C19 C20 . 119.7(6)
C19 C20 H20 . 120.2
C21 C20 C19 . 119.5(6)
C21 C20 H20 . 120.2
C20 C21 H21 . 119.5
C22 C21 C20 . 121.0(6)
C22 C21 H21 . 119.5
C21 C22 H22 . 119.9
C21 C22 C23 . 120.2(5)
C23 C22 H22 . 119.9
C22 C23 H23 . 120.3
C24 C23 C22 . 119.5(5)
C24 C23 H23 . 120.3
C19 C24 P2 . 116.7(4)
C23 C24 P2 . 123.3(4)
C23 C24 C19 . 120.1(5)
C26 C25 H25 . 119.8
C26 C25 C30 . 120.4(5)
C30 C25 H25 . 119.8
C25 C26 H26 . 119.6
C25 C26 C27 . 120.8(5)
C27 C26 H26 . 119.6
C26 C27 H27 . 120.5
C26 C27 C28 . 119.0(6)
C28 C27 H27 . 120.5
C27 C28 H28 . 119.5
C29 C28 C27 . 120.9(6)
C29 C28 H28 . 119.5
C28 C29 H29 . 119.9
C28 C29 C30 . 120.2(6)
C30 C29 H29 . 119.9
C25 C30 P2 . 118.6(4)
C29 C30 P2 . 122.6(4)
C29 C30 C25 . 118.7(5)
C32 C31 H31 . 119.9
C32 C31 C36 . 120.3(6)
C36 C31 H31 . 119.9
C31 C32 H32 . 119.8
C33 C32 C31 . 120.4(6)
C33 C32 H32 . 119.8
C32 C33 H33 . 119.8
C32 C33 C34 . 120.3(5)
C34 C33 H33 . 119.8
C33 C34 H34 . 120.0
C35 C34 C33 . 120.0(6)
C35 C34 H34 . 120.0
C34 C35 H35 . 119.9
C34 C35 C36 . 120.1(5)
C36 C35 H35 . 119.9
C31 C36 P2 . 123.3(4)
C31 C36 C35 . 118.9(5)
C35 C36 P2 . 117.8(4)
S1 C37 H37A . 109.5
S1 C37 H37B . 109.5
S1 C37 H37C . 109.5
H37A C37 H37B . 109.5
H37A C37 H37C . 109.5
H37B C37 H37C . 109.5
S1 C38 H38A . 109.5
S1 C38 H38B . 109.5
S1 C38 H38C . 109.5
H38A C38 H38B . 109.5
H38A C38 H38C . 109.5
H38B C38 H38C . 109.5
O2 N1 O1 . 117.3(15)
O3 N1 O1 . 116(3)
O3 N1 O2 . 125(3)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Ag1 Cl1 . 2.6799(8)
Ag1 P1 . 2.4303(15)
Ag1 P2 . 2.4200(14)
Ag1 O4 . 2.371(4)
Cl1 Ag1 2_556 2.6799(8)
S1 O4 . 1.497(4)
S1 C37 . 1.762(7)
S1 C38 . 1.755(7)
P1 C6 . 1.804(5)
P1 C12 . 1.808(6)
P1 C18 . 1.810(6)
P2 C24 . 1.813(5)
P2 C30 . 1.811(6)
P2 C36 . 1.811(5)
C1 H1 . 0.9300
C1 C2 . 1.376(9)
C1 C6 . 1.377(8)
C2 H2 . 0.9300
C2 C3 . 1.370(9)
C3 H3 . 0.9300
C3 C4 . 1.351(9)
C4 H4 . 0.9300
C4 C5 . 1.378(8)
C5 H5 . 0.9300
C5 C6 . 1.381(8)
C7 H7 . 0.9300
C7 C8 . 1.376(10)
C7 C12 . 1.365(9)
C8 H8 . 0.9300
C8 C9 . 1.365(10)
C9 H9 . 0.9300
C9 C10 . 1.361(10)
C10 H10 . 0.9300
C10 C11 . 1.367(10)
C11 H11 . 0.9300
C11 C12 . 1.382(9)
C13 H13 . 0.9300
C13 C14 . 1.356(9)
C13 C18 . 1.366(8)
C14 H14 . 0.9300
C14 C15 . 1.357(9)
C15 H15 . 0.9300
C15 C16 . 1.376(9)
C16 H16 . 0.9300
C16 C17 . 1.366(9)
C17 H17 . 0.9300
C17 C18 . 1.379(8)
C19 H19 . 0.9300
C19 C20 . 1.374(9)
C19 C24 . 1.374(8)
C20 H20 . 0.9300
C20 C21 . 1.362(9)
C21 H21 . 0.9300
C21 C22 . 1.349(9)
C22 H22 . 0.9300
C22 C23 . 1.372(8)
C23 H23 . 0.9300
C23 C24 . 1.371(7)
C25 H25 . 0.9300
C25 C26 . 1.358(9)
C25 C30 . 1.381(7)
C26 H26 . 0.9300
C26 C27 . 1.365(9)
C27 H27 . 0.9300
C27 C28 . 1.371(8)
C28 H28 . 0.9300
C28 C29 . 1.357(9)
C29 H29 . 0.9300
C29 C30 . 1.379(8)
C31 H31 . 0.9300
C31 C32 . 1.372(8)
C31 C36 . 1.379(8)
C32 H32 . 0.9300
C32 C33 . 1.348(9)
C33 H33 . 0.9300
C33 C34 . 1.375(9)
C34 H34 . 0.9300
C34 C35 . 1.368(8)
C35 H35 . 0.9300
C35 C36 . 1.384(8)
C37 H37A . 0.9600
C37 H37B . 0.9600
C37 H37C . 0.9600
C38 H38A . 0.9600
C38 H38B . 0.9600
C38 H38C . 0.9600
N1 O1 . 1.27(4)
N1 O2 . 1.20(4)
N1 O3 . 1.20(2)
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
C1 H1 O4 . 0.93 2.50 3.381(8) 159
C4 H4 O2 2_566 0.93 2.45 3.14(2) 131
C16 H16 O1 2_666 0.93 2.24 3.00(2) 138
C37 H37A O3 2_556 0.96 2.43 3.321(16) 155
C38 H38A O2 2_556 0.96 2.26 3.095(18) 145
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_4
_geom_torsion
Ag1 P1 C6 C1 . 24.1(6)
Ag1 P1 C6 C5 . -154.1(5)
Ag1 P1 C12 C7 . -141.1(5)
Ag1 P1 C12 C11 . 40.0(5)
Ag1 P1 C18 C13 . -118.9(4)
Ag1 P1 C18 C17 . 56.3(4)
Ag1 P2 C24 C19 . 45.1(5)
Ag1 P2 C24 C23 . -134.8(4)
Ag1 P2 C30 C25 . 27.7(5)
Ag1 P2 C30 C29 . -150.8(4)
Ag1 P2 C36 C31 . -119.3(4)
Ag1 P2 C36 C35 . 57.7(5)
Cl1 Ag1 P1 C6 . 51.4(2)
Cl1 Ag1 P1 C12 . 178.7(2)
Cl1 Ag1 P1 C18 . -65.0(2)
Cl1 Ag1 P2 C24 . -170.54(18)
Cl1 Ag1 P2 C30 . 71.10(19)
Cl1 Ag1 P2 C36 . -51.5(2)
Cl1 Ag1 O4 S1 . 48.0(4)
P1 Ag1 Cl1 Ag1 2_556 -16E1(10)
P1 Ag1 P2 C24 . 52.6(2)
P1 Ag1 P2 C30 . -65.8(2)
P1 Ag1 P2 C36 . 171.7(2)
P1 Ag1 O4 S1 . 169.9(3)
P2 Ag1 Cl1 Ag1 2_556 7E1(10)
P2 Ag1 P1 C6 . 179.4(2)
P2 Ag1 P1 C12 . -53.3(2)
P2 Ag1 P1 C18 . 62.9(2)
P2 Ag1 O4 S1 . -54.2(4)
O4 Ag1 Cl1 Ag1 2_556 -6E1(10)
O4 Ag1 P1 C6 . -50.1(3)
O4 Ag1 P1 C12 . 77.2(2)
O4 Ag1 P1 C18 . -166.6(2)
O4 Ag1 P2 C24 . -68.6(2)
O4 Ag1 P2 C30 . 173.0(2)
O4 Ag1 P2 C36 . 50.5(3)
C1 C2 C3 C4 . 0.8(12)
C2 C1 C6 P1 . -178.0(5)
C2 C1 C6 C5 . 0.3(10)
C2 C3 C4 C5 . 0.3(11)
C3 C4 C5 C6 . -1.1(10)
C4 C5 C6 P1 . 179.0(5)
C4 C5 C6 C1 . 0.8(10)
C6 P1 C12 C7 . -7.2(6)
C6 P1 C12 C11 . 173.8(5)
C6 P1 C18 C13 . 114.9(5)
C6 P1 C18 C17 . -69.9(5)
C6 C1 C2 C3 . -1.1(11)
C7 C8 C9 C10 . -1.6(11)
C8 C7 C12 P1 . -177.5(5)
C8 C7 C12 C11 . 1.4(9)
C8 C9 C10 C11 . 0.0(11)
C9 C10 C11 C12 . 2.3(10)
C10 C11 C12 P1 . 176.0(5)
C10 C11 C12 C7 . -3.0(9)
C12 P1 C6 C1 . -109.1(5)
C12 P1 C6 C5 . 72.6(6)
C12 P1 C18 C13 . 6.2(5)
C12 P1 C18 C17 . -178.6(4)
C12 C7 C8 C9 . 0.9(10)
C13 C14 C15 C16 . 0.1(10)
C14 C13 C18 P1 . 175.2(5)
C14 C13 C18 C17 . 0.2(8)
C14 C15 C16 C17 . -0.8(9)
C15 C16 C17 C18 . 1.2(9)
C16 C17 C18 P1 . -176.4(5)
C16 C17 C18 C13 . -0.9(8)
C18 P1 C6 C1 . 142.8(5)
C18 P1 C6 C5 . -35.5(6)
C18 P1 C12 C7 . 100.6(5)
C18 P1 C12 C11 . -78.3(5)
C18 C13 C14 C15 . 0.2(9)
C19 C20 C21 C22 . 0.1(9)
C20 C19 C24 P2 . 177.5(4)
C20 C19 C24 C23 . -2.6(8)
C20 C21 C22 C23 . -1.3(9)
C21 C22 C23 C24 . 0.5(8)
C22 C23 C24 P2 . -178.7(4)
C22 C23 C24 C19 . 1.4(8)
C24 P2 C30 C25 . -94.2(5)
C24 P2 C30 C29 . 87.4(5)
C24 P2 C36 C31 . 4.6(5)
C24 P2 C36 C35 . -178.5(4)
C24 C19 C20 C21 . 1.8(9)
C25 C26 C27 C28 . 0.0(10)
C26 C25 C30 P2 . -179.5(4)
C26 C25 C30 C29 . -1.0(8)
C26 C27 C28 C29 . -0.6(10)
C27 C28 C29 C30 . 0.3(10)
C28 C29 C30 P2 . 178.9(5)
C28 C29 C30 C25 . 0.4(9)
C30 P2 C24 C19 . 167.4(4)
C30 P2 C24 C23 . -12.5(5)
C30 P2 C36 C31 . 114.4(5)
C30 P2 C36 C35 . -68.7(5)
C30 C25 C26 C27 . 0.8(9)
C31 C32 C33 C34 . 0.4(9)
C32 C31 C36 P2 . 177.0(5)
C32 C31 C36 C35 . 0.1(8)
C32 C33 C34 C35 . -0.6(9)
C33 C34 C35 C36 . 0.6(9)
C34 C35 C36 P2 . -177.4(4)
C34 C35 C36 C31 . -0.4(8)
C36 P2 C24 C19 . -83.8(5)
C36 P2 C24 C23 . 96.3(5)
C36 P2 C30 C25 . 158.5(4)
C36 P2 C30 C29 . -20.0(5)
C36 C31 C32 C33 . -0.1(9)
C37 S1 O4 Ag1 . -81.7(4)
C38 S1 O4 Ag1 . 21.0(5)

_cod_database_fobs_code 1542727
