#------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/49/4064994.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_4064994
loop_
_publ_author_name
'Zhou, Xiaoyuan'
'Jordan, Richard F.'
_publ_section_title
;
 Synthesis,cis/transIsomerization, and Reactivity of Palladium Alkyl
 Complexes That Contain a Chelating N-Heterocyclic-Carbene Sulfonate
 Ligand
;
_journal_issue                   17
_journal_name_full               Organometallics
_journal_page_first              4632
_journal_paper_doi               10.1021/om200482a
_journal_volume                  30
_journal_year                    2011
_chemical_formula_sum            'C31.5 H40 Cl3 N3 O4 Pd S'
_chemical_formula_weight         769.48
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_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                108.711(3)
_cell_angle_beta                 91.482(3)
_cell_angle_gamma                115.680(3)
_cell_formula_units_Z            2
_cell_length_a                   11.1855(18)
_cell_length_b                   11.4657(19)
_cell_length_c                   16.171(3)
_cell_measurement_temperature    100(2)
_cell_volume                     1737.0(5)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_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  0.0667
_diffrn_reflns_av_sigmaI/netI    0.1394
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            16944
_diffrn_reflns_theta_full        25.10
_diffrn_reflns_theta_max         25.10
_diffrn_reflns_theta_min         2.05
_exptl_absorpt_coefficient_mu    0.864
_exptl_crystal_density_diffrn    1.471
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             790
_refine_diff_density_max         0.432
_refine_diff_density_min         -0.437
_refine_diff_density_rms         0.084
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.799
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     425
_refine_ls_number_reflns         6149
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.799
_refine_ls_R_factor_all          0.0764
_refine_ls_R_factor_gt           0.0430
_refine_ls_shift/su_max          0.396
_refine_ls_shift/su_mean         0.005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0169P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0734
_refine_ls_wR_factor_ref         0.0790
_reflns_number_gt                3941
_reflns_number_total             6149
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om200482a_si_002.cif
_cod_data_source_block           7
_cod_original_formula_sum        'C31.50 H40 Cl3 N3 O4 Pd S'
_cod_database_code               4064994
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
C1 C 0.5842(5) 0.5500(6) 0.6353(3) 0.0270(13) Uani 1 1 d .
C2 C 0.5219(5) 0.6392(6) 0.6252(4) 0.0491(17) Uani 1 1 d .
H2A H 0.5381 0.6567 0.5701 0.074 Uiso 1 1 calc R
H2B H 0.5629 0.7279 0.6760 0.074 Uiso 1 1 calc R
H2C H 0.4244 0.5908 0.6230 0.074 Uiso 1 1 calc R
C3 C 0.7967(5) 0.4107(5) 0.5324(3) 0.0267(13) Uani 1 1 d .
C4 C 0.8209(5) 0.3417(5) 0.4521(3) 0.0278(13) Uani 1 1 d .
H4 H 0.8136 0.2517 0.4396 0.033 Uiso 1 1 calc R
C5 C 0.8562(5) 0.4059(5) 0.3900(3) 0.0282(13) Uani 1 1 d .
H5 H 0.8724 0.3604 0.3345 0.034 Uiso 1 1 calc R
C6 C 0.8669(5) 0.5365(5) 0.4111(3) 0.0296(14) Uani 1 1 d .
H6 H 0.8911 0.5816 0.3695 0.036 Uiso 1 1 calc R
C7 C 0.8429(5) 0.6041(5) 0.4925(3) 0.0251(13) Uani 1 1 d .
C8 C 0.7617(5) 0.3448(5) 0.6011(3) 0.0326(14) Uani 1 1 d .
H8A H 0.8450 0.3685 0.6390 0.049 Uiso 1 1 calc R
H8B H 0.7102 0.2434 0.5713 0.049 Uiso 1 1 calc R
H8C H 0.7071 0.3794 0.6378 0.049 Uiso 1 1 calc R
C9 C 0.8525(5) 0.7458(5) 0.5153(3) 0.0344(14) Uani 1 1 d .
H9A H 0.7863 0.7538 0.5523 0.052 Uiso 1 1 calc R
H9B H 0.8338 0.7593 0.4605 0.052 Uiso 1 1 calc R
H9C H 0.9437 0.8169 0.5481 0.052 Uiso 1 1 calc R
C10 C 0.9667(5) 0.9923(5) 0.7537(3) 0.0221(12) Uani 1 1 d .
C11 C 1.0116(5) 1.0772(5) 0.7034(3) 0.0292(13) Uani 1 1 d .
H11 H 1.0937 1.0928 0.6823 0.035 Uiso 1 1 calc R
C12 C 0.9377(5) 1.1381(5) 0.6843(3) 0.0326(14) Uani 1 1 d .
H12 H 0.9684 1.1938 0.6491 0.039 Uiso 1 1 calc R
C13 C 0.8203(5) 1.1197(5) 0.7154(3) 0.0315(14) Uani 1 1 d .
H13 H 0.7717 1.1648 0.7034 0.038 Uiso 1 1 calc R
C14 C 0.7730(5) 1.0347(5) 0.7644(3) 0.0274(13) Uani 1 1 d .
H14 H 0.6910 1.0207 0.7853 0.033 Uiso 1 1 calc R
C15 C 0.8452(5) 0.9698(5) 0.7833(3) 0.0239(12) Uani 1 1 d .
C16 C 0.7551(5) 0.7447(5) 0.7999(3) 0.0199(12) Uani 1 1 d .
C17 C 0.7883(5) 0.9366(5) 0.9278(3) 0.0339(14) Uani 1 1 d .
H17A H 0.7308 0.9836 0.9392 0.041 Uiso 1 1 calc R
H17B H 0.8809 1.0025 0.9626 0.041 Uiso 1 1 calc R
C18 C 0.7289(5) 0.8051(5) 0.9490(3) 0.0282(13) Uani 1 1 d .
H18A H 0.7896 0.8130 0.9984 0.034 Uiso 1 1 calc R
H18B H 0.6392 0.7853 0.9652 0.034 Uiso 1 1 calc R
C19 C 0.6763(5) 0.5547(5) 0.8583(3) 0.0245(13) Uani 1 1 d .
C20 C 0.5377(5) 0.4609(5) 0.8419(3) 0.0287(13) Uani 1 1 d .
C21 C 0.5033(6) 0.3247(5) 0.8362(3) 0.0350(14) Uani 1 1 d .
H21 H 0.4107 0.2594 0.8265 0.042 Uiso 1 1 calc R
C22 C 0.6006(6) 0.2841(5) 0.8443(3) 0.0426(16) Uani 1 1 d .
H22 H 0.5747 0.1904 0.8372 0.051 Uiso 1 1 calc R
C23 C 0.7351(6) 0.3787(5) 0.8625(3) 0.0357(14) Uani 1 1 d .
H23 H 0.8010 0.3499 0.8704 0.043 Uiso 1 1 calc R
C24 C 0.7776(5) 0.5157(5) 0.8696(3) 0.0250(12) Uani 1 1 d .
C25 C 0.4286(5) 0.5060(6) 0.8368(3) 0.0338(14) Uani 1 1 d .
H25 H 0.4709 0.5976 0.8291 0.041 Uiso 1 1 calc R
C26 C 0.3109(5) 0.4045(6) 0.7598(4) 0.0519(18) Uani 1 1 d .
H26A H 0.3438 0.3949 0.7037 0.078 Uiso 1 1 calc R
H26B H 0.2448 0.4393 0.7602 0.078 Uiso 1 1 calc R
H26C H 0.2680 0.3136 0.7658 0.078 Uiso 1 1 calc R
C27 C 0.3760(6) 0.5267(7) 0.9244(4) 0.059(2) Uani 1 1 d .
H27A H 0.3290 0.4370 0.9317 0.089 Uiso 1 1 calc R
H27B H 0.3132 0.5651 0.9232 0.089 Uiso 1 1 calc R
H27C H 0.4522 0.5914 0.9744 0.089 Uiso 1 1 calc R
C28 C 0.9277(5) 0.6210(6) 0.8958(3) 0.0350(14) Uani 1 1 d .
H28 H 0.9380 0.7051 0.8841 0.042 Uiso 1 1 calc R
C29 C 0.9778(5) 0.6663(5) 0.9949(3) 0.0454(16) Uani 1 1 d .
H29A H 0.9284 0.7117 1.0290 0.068 Uiso 1 1 calc R
H29B H 1.0747 0.7318 1.0104 0.068 Uiso 1 1 calc R
H29C H 0.9626 0.5846 1.0090 0.068 Uiso 1 1 calc R
C30 C 1.0156(6) 0.5647(6) 0.8404(4) 0.0550(18) Uani 1 1 d .
H30A H 1.0083 0.4827 0.8511 0.082 Uiso 1 1 calc R
H30B H 1.1102 0.6370 0.8580 0.082 Uiso 1 1 calc R
H30C H 0.9839 0.5389 0.7770 0.082 Uiso 1 1 calc R
C31 C 0.6172(6) 0.9102(6) 0.3797(4) 0.0297(16) Uani 0.85 1 d P
H31A H 0.5549 0.8119 0.3699 0.036 Uiso 0.85 1 calc PR
H31B H 0.6613 0.9113 0.3274 0.036 Uiso 0.85 1 calc PR
C32 C 0.6279(11) 0.0687(13) 0.1086(7) 0.100(5) Uani 0.65 1 d P
H32A H 0.6484 0.0059 0.1294 0.121 Uiso 0.65 1 calc PR
H32B H 0.7105 0.1288 0.0920 0.121 Uiso 0.65 1 calc PR
Cl1 Cl 0.52252(16) 0.99974(16) 0.38606(11) 0.0373(4) Uani 0.85 1 d P
Cl2 Cl 0.74057(16) 0.97897(16) 0.47387(10) 0.0342(4) Uani 0.85 1 d P
Cl3A Cl 0.6362(7) 0.1777(7) 0.0282(4) 0.048(3) Uani 0.244(4) 1 d P
Cl3B Cl 0.5099(15) 0.0390(9) -0.0072(10) 0.105(5) Uani 0.394(4) 1 d P
Cl4 Cl 0.5898(3) 0.1703(3) 0.19334(19) 0.0845(14) Uani 0.656(4) 1 d P
N1 N 0.8085(4) 0.5421(4) 0.5531(2) 0.0198(10) Uani 1 1 d .
N2 N 0.7886(4) 0.8802(4) 0.8315(2) 0.0201(10) Uani 1 1 d .
N3 N 0.7174(4) 0.6961(4) 0.8650(3) 0.0207(10) Uani 1 1 d .
O1 O 0.5169(4) 0.4247(4) 0.6116(2) 0.0497(11) Uani 1 1 d .
O2 O 1.0034(3) 0.7737(3) 0.7211(2) 0.0249(8) Uani 1 1 d .
O3 O 1.0711(3) 0.9408(3) 0.8741(2) 0.0304(9) Uani 1 1 d .
O4 O 1.2004(3) 0.9974(3) 0.7609(2) 0.0368(10) Uani 1 1 d .
Pd1 Pd 0.77935(4) 0.64670(4) 0.67938(3) 0.02048(12) Uani 1 1 d .
S1 S 1.07002(13) 0.92206(13) 0.78107(9) 0.0264(3) Uani 1 1 d .
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pd Pd -0.9988 1.0072 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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
O1 C1 C2 121.0(5) . .
O1 C1 Pd1 122.9(4) . .
C2 C1 Pd1 115.9(4) . .
N1 C3 C4 121.7(5) . .
N1 C3 C8 118.1(4) . .
C4 C3 C8 120.2(4) . .
C3 C4 C5 119.3(5) . .
C6 C5 C4 118.5(5) . .
C5 C6 C7 121.1(5) . .
N1 C7 C6 120.6(5) . .
N1 C7 C9 118.1(4) . .
C6 C7 C9 121.4(5) . .
C15 C10 C11 118.9(5) . .
C15 C10 S1 122.3(4) . .
C11 C10 S1 118.8(4) . .
C12 C11 C10 120.4(5) . .
C13 C12 C11 121.0(5) . .
C12 C13 C14 119.6(5) . .
C13 C14 C15 120.4(5) . .
C10 C15 C14 119.7(5) . .
C10 C15 N2 122.8(4) . .
C14 C15 N2 117.5(5) . .
N2 C16 N3 107.8(4) . .
N2 C16 Pd1 123.2(3) . .
N3 C16 Pd1 128.7(3) . .
N2 C17 C18 101.6(4) . .
N3 C18 C17 103.3(4) . .
C20 C19 C24 122.1(5) . .
C20 C19 N3 119.4(5) . .
C24 C19 N3 118.5(5) . .
C21 C20 C19 117.1(5) . .
C21 C20 C25 120.7(5) . .
C19 C20 C25 122.0(5) . .
C22 C21 C20 121.5(5) . .
C23 C22 C21 120.1(5) . .
C22 C23 C24 121.9(5) . .
C23 C24 C19 117.2(5) . .
C23 C24 C28 120.7(5) . .
C19 C24 C28 121.9(4) . .
C26 C25 C20 113.5(5) . .
C26 C25 C27 109.4(4) . .
C20 C25 C27 109.9(4) . .
C29 C28 C24 110.3(4) . .
C29 C28 C30 110.6(4) . .
C24 C28 C30 112.6(4) . .
Cl2 C31 Cl1 114.0(3) . .
Cl4 C32 Cl3B 114.0(7) . 2_655
Cl3B Cl3B C32 91.0(18) 2_655 2_655
Cl3B Cl3B Cl3A 32.8(15) 2_655 2_655
C32 Cl3B Cl3A 59.7(5) 2_655 2_655
C7 N1 C3 118.8(4) . .
C7 N1 Pd1 121.1(3) . .
C3 N1 Pd1 120.1(3) . .
C16 N2 C15 123.7(4) . .
C16 N2 C17 113.8(4) . .
C15 N2 C17 121.5(4) . .
C16 N3 C19 125.2(4) . .
C16 N3 C18 112.9(4) . .
C19 N3 C18 121.8(4) . .
S1 O2 Pd1 122.65(18) . .
C1 Pd1 C16 90.84(19) . .
C1 Pd1 N1 90.18(18) . .
C16 Pd1 N1 178.65(18) . .
C1 Pd1 O2 173.19(18) . .
C16 Pd1 O2 90.67(16) . .
N1 Pd1 O2 88.42(13) . .
O4 S1 O3 114.8(2) . .
O4 S1 O2 110.9(2) . .
O3 S1 O2 113.0(2) . .
O4 S1 C10 105.9(2) . .
O3 S1 C10 106.1(2) . .
O2 S1 C10 105.4(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.213(5) .
C1 C2 1.508(7) .
C1 Pd1 1.954(5) .
C3 N1 1.379(5) .
C3 C4 1.389(6) .
C3 C8 1.505(6) .
C4 C5 1.396(6) .
C5 C6 1.374(6) .
C6 C7 1.397(6) .
C7 N1 1.357(6) .
C7 C9 1.499(6) .
C10 C15 1.397(6) .
C10 C11 1.403(6) .
C10 S1 1.786(5) .
C11 C12 1.375(6) .
C12 C13 1.372(6) .
C13 C14 1.389(6) .
C14 C15 1.398(6) .
C15 N2 1.428(6) .
C16 N2 1.338(5) .
C16 N3 1.339(5) .
C16 Pd1 2.006(5) .
C17 N2 1.483(5) .
C17 C18 1.519(6) .
C18 N3 1.478(5) .
C19 C20 1.407(6) .
C19 C24 1.414(6) .
C19 N3 1.446(6) .
C20 C21 1.406(6) .
C20 C25 1.527(7) .
C21 C22 1.375(7) .
C22 C23 1.373(7) .
C23 C24 1.393(6) .
C24 C28 1.527(6) .
C25 C26 1.515(7) .
C25 C27 1.536(6) .
C28 C29 1.523(6) .
C28 C30 1.553(7) .
C31 Cl2 1.739(6) .
C31 Cl1 1.751(6) .
C32 Cl4 1.688(10) .
C32 Cl3B 1.873(18) 2_655
Cl3A Cl3B 2.208(12) 2_655
Cl3B Cl3B 0.933(16) 2_655
Cl3B C32 1.873(18) 2_655
Cl3B Cl3A 2.208(12) 2_655
N1 Pd1 2.126(4) .
O2 S1 1.482(3) .
O2 Pd1 2.231(3) .
O3 S1 1.449(3) .
O4 S1 1.447(3) .
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
N1 C3 C4 C5 -1.0(7)
C8 C3 C4 C5 -178.6(4)
C3 C4 C5 C6 0.6(7)
C4 C5 C6 C7 -0.2(8)
C5 C6 C7 N1 0.2(8)
C5 C6 C7 C9 -179.1(5)
C15 C10 C11 C12 0.5(7)
S1 C10 C11 C12 -177.1(4)
C10 C11 C12 C13 1.3(8)
C11 C12 C13 C14 -2.1(8)
C12 C13 C14 C15 0.9(7)
C11 C10 C15 C14 -1.7(7)
S1 C10 C15 C14 175.9(3)
C11 C10 C15 N2 177.2(4)
S1 C10 C15 N2 -5.2(6)
C13 C14 C15 C10 1.0(7)
C13 C14 C15 N2 -178.0(4)
N2 C17 C18 N3 5.6(5)
C24 C19 C20 C21 -0.6(7)
N3 C19 C20 C21 -179.9(4)
C24 C19 C20 C25 175.2(4)
N3 C19 C20 C25 -4.1(7)
C19 C20 C21 C22 -1.5(7)
C25 C20 C21 C22 -177.3(4)
C20 C21 C22 C23 3.1(8)
C21 C22 C23 C24 -2.7(8)
C22 C23 C24 C19 0.7(7)
C22 C23 C24 C28 176.1(5)
C20 C19 C24 C23 0.9(7)
N3 C19 C24 C23 -179.8(4)
C20 C19 C24 C28 -174.3(4)
N3 C19 C24 C28 5.0(7)
C21 C20 C25 C26 -48.5(6)
C19 C20 C25 C26 135.9(5)
C21 C20 C25 C27 74.3(6)
C19 C20 C25 C27 -101.3(6)
C23 C24 C28 C29 -74.9(6)
C19 C24 C28 C29 100.2(5)
C23 C24 C28 C30 49.1(6)
C19 C24 C28 C30 -135.8(5)
C6 C7 N1 C3 -0.5(7)
C9 C7 N1 C3 178.8(4)
C6 C7 N1 Pd1 177.5(3)
C9 C7 N1 Pd1 -3.2(6)
C4 C3 N1 C7 1.0(7)
C8 C3 N1 C7 178.6(4)
C4 C3 N1 Pd1 -177.1(4)
C8 C3 N1 Pd1 0.5(6)
N3 C16 N2 C15 174.3(4)
Pd1 C16 N2 C15 -0.1(6)
N3 C16 N2 C17 6.1(6)
Pd1 C16 N2 C17 -168.3(3)
C10 C15 N2 C16 -59.2(7)
C14 C15 N2 C16 119.8(5)
C10 C15 N2 C17 108.2(5)
C14 C15 N2 C17 -72.9(6)
C18 C17 N2 C16 -7.5(6)
C18 C17 N2 C15 -176.0(4)
N2 C16 N3 C19 -178.6(4)
Pd1 C16 N3 C19 -4.7(7)
N2 C16 N3 C18 -1.9(5)
Pd1 C16 N3 C18 172.1(3)
C20 C19 N3 C16 -99.6(6)
C24 C19 N3 C16 81.1(6)
C20 C19 N3 C18 83.9(6)
C24 C19 N3 C18 -95.4(5)
C17 C18 N3 C16 -2.7(5)
C17 C18 N3 C19 174.2(4)
O1 C1 Pd1 C16 -115.1(5)
C2 C1 Pd1 C16 69.5(4)
O1 C1 Pd1 N1 64.0(5)
C2 C1 Pd1 N1 -111.4(4)
O1 C1 Pd1 O2 142.1(13)
C2 C1 Pd1 O2 -33.3(17)
N2 C16 Pd1 C1 -107.6(4)
N3 C16 Pd1 C1 79.3(4)
N2 C16 Pd1 N1 113(8)
N3 C16 Pd1 N1 -60(8)
N2 C16 Pd1 O2 65.7(4)
N3 C16 Pd1 O2 -107.4(4)
C7 N1 Pd1 C1 97.6(4)
C3 N1 Pd1 C1 -84.4(4)
C7 N1 Pd1 C16 -123(8)
C3 N1 Pd1 C16 55(8)
C7 N1 Pd1 O2 -75.7(4)
C3 N1 Pd1 O2 102.3(4)
S1 O2 Pd1 C1 66.3(16)
S1 O2 Pd1 C16 -36.5(2)
S1 O2 Pd1 N1 144.5(2)
Pd1 O2 S1 O4 -148.9(2)
Pd1 O2 S1 O3 80.6(3)
Pd1 O2 S1 C10 -34.8(3)
C15 C10 S1 O4 -164.4(4)
C11 C10 S1 O4 13.2(4)
C15 C10 S1 O3 -42.0(4)
C11 C10 S1 O3 135.6(4)
C15 C10 S1 O2 78.0(4)
C11 C10 S1 O2 -104.4(4)
