#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/58/7105807.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_7105807
loop_
_publ_author_name
'Manuel Alcarazo'
'Karin Radkowski'
'Richard Goddard'
'Alois Furstner'
_publ_section_title
;
 Metal complexes with carbene ligands stabilized by lateral enamines
;
_journal_name_full               Chem.Commun.
_journal_page_first              776
_journal_paper_doi               10.1039/c0cc03128c
_journal_volume                  47
_journal_year                    2011
_chemical_compound_source        dichloromethane/diethylether
_chemical_formula_moiety
'2(C44 H44 Cl N2 P2 Pd 1+),2(B F4 1-),5(C H2 Cl2)'
_chemical_formula_sum            'C93 H98 B2 Cl12 F8 N4 P4 Pd2'
_chemical_formula_weight         2207.45
_chemical_name_systematic
;
N-methyl-3-(dimethylamino-methylidenyl)-4,5-dihydropyrrolyliden-2-yl-
bis-(triphenylphosphine)-chloro-palladium(ii) tetrafluoroborate
tris-dichloromethane solute
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_block_code                AVM-AB-407-01
_audit_creation_date             2010-07-06
_cell_angle_alpha                90.00
_cell_angle_beta                 125.390(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   32.7088(4)
_cell_length_b                   16.8288(2)
_cell_length_c                   23.4760(3)
_cell_measurement_reflns_used    278975
_cell_measurement_temperature    160
_cell_measurement_theta_max      33.14
_cell_measurement_theta_min      2.91
_cell_volume                     10534.7(3)
_computing_cell_refinement       'DENZO (Bruker AXS, 2006)'
_computing_data_collection       'DATCOL (Bruker AXS, 2006)'
_computing_data_reduction        'DENZO (Bruker AXS, 2006)'
_computing_molecular_graphics    'DIAMOND (Crystal Impact GbR, 2005)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      160
_diffrn_detector_area_resol_mean 18.02
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measurement_device_type  'Bruker AXS Enraf-Nonius KappaCCD'
_diffrn_measurement_method       'CCD φ- and ω-scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         '0.2 x 2mm^2^ focus rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0393
_diffrn_reflns_av_sigmaI/netI    0.0271
_diffrn_reflns_limit_h_max       50
_diffrn_reflns_limit_h_min       -50
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_number            115104
_diffrn_reflns_theta_full        33.19
_diffrn_reflns_theta_max         33.19
_diffrn_reflns_theta_min         6.81
_exptl_absorpt_coefficient_mu    0.764
_exptl_absorpt_correction_T_max  0.87787
_exptl_absorpt_correction_T_min  0.76729
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details   'SADABS (Bruker AXS, 2008)'
_exptl_crystal_colour            pale-yellow
_exptl_crystal_density_diffrn    1.392
_exptl_crystal_description       prism
_exptl_crystal_F_000             4488
_exptl_crystal_size_max          0.065
_exptl_crystal_size_mid          0.065
_exptl_crystal_size_min          0.050
_refine_diff_density_max         2.272
_refine_diff_density_min         -1.906
_refine_diff_density_rms         0.158
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     554
_refine_ls_number_reflns         19883
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0834
_refine_ls_R_factor_gt           0.0699
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1208P)²+48.4188P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2073
_refine_ls_wR_factor_ref         0.2197
_reflns_number_gt                16131
_reflns_number_total             19883
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0CC03128C.TXT
_cod_data_source_block           4
_cod_original_cell_volume        10534.7(2)
_cod_original_sg_symbol_Hall     '-c 2yc'
_cod_database_code               7105807
loop_
_symmetry_equiv_pos_as_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_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
C1 C 0.18259(11) 0.18248(16) 0.18670(14) 0.0255(5) Uani 1 1 d . . .
C2 C 0.12987(12) 0.19689(18) 0.14008(17) 0.0324(6) Uani 1 1 d . . .
C3 C 0.11254(13) 0.2739(2) 0.1265(2) 0.0392(8) Uani 1 1 d . . .
H3 H 0.1382 0.3131 0.1479 0.047 Uiso 1 1 calc R . .
C4 C 0.0577(2) 0.3890(3) 0.0875(3) 0.0723(17) Uani 1 1 d . . .
H4A H 0.0525 0.4021 0.1236 0.108 Uiso 1 1 calc R . .
H4B H 0.0280 0.4044 0.0416 0.108 Uiso 1 1 calc R . .
H4C H 0.0871 0.4177 0.0968 0.108 Uiso 1 1 calc R . .
C5 C 0.0214(2) 0.2539(4) 0.0568(6) 0.108(4) Uani 1 1 d . . .
H5A H 0.0250 0.2075 0.0348 0.162 Uiso 1 1 calc R . .
H5B H -0.0080 0.2847 0.0213 0.162 Uiso 1 1 calc R . .
H5C H 0.0172 0.2363 0.0929 0.162 Uiso 1 1 calc R . .
C6 C 0.10325(14) 0.1165(2) 0.1152(2) 0.0428(8) Uani 1 1 d . . .
H6A H 0.0849 0.1109 0.0639 0.051 Uiso 1 1 calc R . .
H6B H 0.0794 0.1098 0.1279 0.051 Uiso 1 1 calc R . .
C7 C 0.14654(13) 0.05577(18) 0.15397(19) 0.0359(7) Uani 1 1 d . . .
H7A H 0.1428 0.0215 0.1849 0.043 Uiso 1 1 calc R . .
H7B H 0.1477 0.0218 0.1205 0.043 Uiso 1 1 calc R . .
C8 C 0.24097(12) 0.06853(19) 0.23965(18) 0.0339(6) Uani 1 1 d . . .
H8A H 0.2666 0.1099 0.2642 0.051 Uiso 1 1 calc R . .
H8B H 0.2478 0.0367 0.2111 0.051 Uiso 1 1 calc R . .
H8C H 0.2416 0.0342 0.2738 0.051 Uiso 1 1 calc R . .
C9 C 0.19517(13) 0.17399(18) 0.33085(17) 0.0312(6) Uani 1 1 d . . .
C10 C 0.14328(15) 0.1639(2) 0.28756(19) 0.0410(8) Uani 1 1 d . . .
H10 H 0.1224 0.2057 0.2574 0.049 Uiso 1 1 calc R . .
C11 C 0.12210(19) 0.0923(3) 0.2886(2) 0.0546(11) Uani 1 1 d . . .
H11 H 0.0867 0.0862 0.2596 0.065 Uiso 1 1 calc R . .
C12 C 0.1517(2) 0.0303(2) 0.3309(3) 0.0535(11) Uani 1 1 d . . .
H12 H 0.1369 -0.0187 0.3300 0.064 Uiso 1 1 calc R . .
C13 C 0.2030(2) 0.0403(2) 0.3747(3) 0.0519(10) Uani 1 1 d . . .
H13 H 0.2237 -0.0018 0.4047 0.062 Uiso 1 1 calc R . .
C14 C 0.22488(16) 0.1117(2) 0.3750(2) 0.0418(8) Uani 1 1 d . . .
H14 H 0.2602 0.1180 0.4055 0.050 Uiso 1 1 calc R . .
C15 C 0.18430(11) 0.34507(17) 0.31567(16) 0.0277(5) Uani 1 1 d . . .
C16 C 0.17974(13) 0.41204(18) 0.27761(17) 0.0321(6) Uani 1 1 d . . .
H16 H 0.1980 0.4149 0.2577 0.039 Uiso 1 1 calc R . .
C17 C 0.14868(15) 0.4752(2) 0.2683(2) 0.0407(7) Uani 1 1 d . . .
H17 H 0.1457 0.5203 0.2418 0.049 Uiso 1 1 calc R . .
C18 C 0.12243(15) 0.4719(3) 0.2976(2) 0.0467(9) Uani 1 1 d . . .
H18 H 0.1010 0.5145 0.2910 0.056 Uiso 1 1 calc R . .
C19 C 0.12736(18) 0.4059(3) 0.3370(3) 0.0521(10) Uani 1 1 d . . .
H19 H 0.1095 0.4040 0.3576 0.063 Uiso 1 1 calc R . .
C20 C 0.15821(15) 0.3428(2) 0.3465(2) 0.0410(7) Uani 1 1 d . . .
H20 H 0.1616 0.2982 0.3738 0.049 Uiso 1 1 calc R . .
C21 C 0.28273(12) 0.27221(18) 0.41195(15) 0.0285(5) Uani 1 1 d . . .
C22 C 0.32542(14) 0.2350(3) 0.4251(2) 0.0418(8) Uani 1 1 d . . .
H22 H 0.3242 0.2088 0.3883 0.050 Uiso 1 1 calc R . .
C23 C 0.36995(16) 0.2362(3) 0.4920(2) 0.0534(11) Uani 1 1 d . . .
H23 H 0.3988 0.2095 0.5012 0.064 Uiso 1 1 calc R . .
C24 C 0.37208(17) 0.2761(3) 0.5450(2) 0.0509(10) Uani 1 1 d . . .
H24 H 0.4026 0.2771 0.5905 0.061 Uiso 1 1 calc R . .
C25 C 0.33034(16) 0.3146(3) 0.53265(18) 0.0422(8) Uani 1 1 d . . .
H25 H 0.3323 0.3427 0.5693 0.051 Uiso 1 1 calc R . .
C26 C 0.28521(13) 0.3118(2) 0.46614(16) 0.0331(6) Uani 1 1 d . . .
H26 H 0.2562 0.3369 0.4577 0.040 Uiso 1 1 calc R . .
C27 C 0.21866(13) 0.17438(19) 0.08696(16) 0.0316(6) Uani 1 1 d . . .
C28 C 0.24891(17) 0.1101(2) 0.0974(2) 0.0438(8) Uani 1 1 d . . .
H28 H 0.2842 0.1137 0.1310 0.053 Uiso 1 1 calc R . .
C29 C 0.2281(2) 0.0402(3) 0.0592(3) 0.0575(12) Uani 1 1 d . . .
H29 H 0.2492 -0.0034 0.0670 0.069 Uiso 1 1 calc R . .
C30 C 0.1774(2) 0.0340(3) 0.0106(3) 0.0569(12) Uani 1 1 d . . .
H30 H 0.1634 -0.0138 -0.0152 0.068 Uiso 1 1 calc R . .
C31 C 0.1463(2) 0.0982(3) -0.0011(2) 0.0518(10) Uani 1 1 d . . .
H31 H 0.1111 0.0940 -0.0351 0.062 Uiso 1 1 calc R . .
C32 C 0.16645(15) 0.1684(2) 0.03676(19) 0.0412(7) Uani 1 1 d . . .
H32 H 0.1452 0.2118 0.0288 0.049 Uiso 1 1 calc R . .
C33 C 0.21169(12) 0.34485(18) 0.08377(16) 0.0291(5) Uani 1 1 d . . .
C34 C 0.19821(15) 0.3444(2) 0.01511(19) 0.0395(7) Uani 1 1 d . . .
H34 H 0.2069 0.3001 -0.0010 0.047 Uiso 1 1 calc R . .
C35 C 0.17228(18) 0.4081(3) -0.0297(2) 0.0504(10) Uani 1 1 d . . .
H35 H 0.1634 0.4073 -0.0760 0.061 Uiso 1 1 calc R . .
C36 C 0.15947(18) 0.4727(3) -0.0062(3) 0.0529(10) Uani 1 1 d . . .
H36 H 0.1418 0.5161 -0.0367 0.063 Uiso 1 1 calc R . .
C37 C 0.17234(16) 0.4742(2) 0.0614(2) 0.0430(8) Uani 1 1 d . . .
H37 H 0.1635 0.5187 0.0770 0.052 Uiso 1 1 calc R . .
C38 C 0.19832(13) 0.41057(19) 0.10636(18) 0.0320(6) Uani 1 1 d . . .
H38 H 0.2070 0.4118 0.1526 0.038 Uiso 1 1 calc R . .
C39 C 0.30918(12) 0.26442(18) 0.17166(17) 0.0303(5) Uani 1 1 d . . .
C40 C 0.32305(14) 0.2979(2) 0.13050(19) 0.0381(7) Uani 1 1 d . . .
H40 H 0.2990 0.3253 0.0886 0.046 Uiso 1 1 calc R . .
C41 C 0.37210(17) 0.2909(3) 0.1513(2) 0.0527(10) Uani 1 1 d . . .
H41 H 0.3816 0.3136 0.1235 0.063 Uiso 1 1 calc R . .
C42 C 0.40755(18) 0.2509(4) 0.2123(3) 0.0579(12) Uani 1 1 d . . .
H42 H 0.4411 0.2463 0.2260 0.069 Uiso 1 1 calc R . .
C43 C 0.39405(17) 0.2175(4) 0.2536(3) 0.0559(11) Uani 1 1 d . . .
H43 H 0.4182 0.1896 0.2951 0.067 Uiso 1 1 calc R . .
C44 C 0.34494(15) 0.2252(3) 0.2335(2) 0.0434(8) Uani 1 1 d . . .
H44 H 0.3358 0.2036 0.2620 0.052 Uiso 1 1 calc R . .
C45 C 0.0723(4) 0.8667(7) 0.1116(5) 0.106(3) Uiso 1 1 d . . .
H45A H 0.0577 0.8128 0.1032 0.127 Uiso 1 1 calc R . .
H45B H 0.1087 0.8638 0.1490 0.127 Uiso 1 1 calc R . .
C46 C 0.5424(5) 0.1605(8) 0.4098(6) 0.121(3) Uiso 1 1 d . . .
H46A H 0.5212 0.1388 0.4235 0.145 Uiso 1 1 calc R . .
H46B H 0.5775 0.1485 0.4488 0.145 Uiso 1 1 calc R . .
C47 C 0.0000 0.0247(7) 0.2500 0.083(3) Uiso 1 2 d S . .
H47A H 0.0217 0.0600 0.2445 0.100 Uiso 0.50 1 calc PR . .
H47B H -0.0217 0.0600 0.2555 0.100 Uiso 0.50 1 calc PR . .
B1 B 0.41209(17) 0.1035(3) 0.4058(3) 0.0419(8) Uani 1 1 d . . .
Cl1 Cl 0.29534(3) 0.36709(4) 0.29013(4) 0.03162(15) Uani 1 1 d . . .
Cl2 Cl 0.05939(14) 0.9129(2) 0.0237(4) 0.238(3) Uani 1 1 d . . .
Cl3 Cl 0.0491(2) 0.9185(2) 0.1290(5) 0.277(4) Uani 1 1 d . . .
Cl4 Cl 0.53749(13) 0.2480(3) 0.4099(3) 0.1801(19) Uani 1 1 d . . .
Cl5 Cl 0.52962(11) 0.1006(4) 0.33845(16) 0.182(2) Uani 1 1 d . . .
Cl6 Cl 0.0342(4) -0.0153(10) 0.3192(7) 0.429(9) Uani 1 1 d . . .
F1 F 0.36113(9) 0.08792(18) 0.35698(14) 0.0530(6) Uani 1 1 d . . .
F2 F 0.41917(14) 0.18538(17) 0.40921(17) 0.0669(8) Uani 1 1 d . . .
F3 F 0.42698(11) 0.0747(2) 0.47054(15) 0.0643(8) Uani 1 1 d . . .
F4 F 0.43832(13) 0.0676(2) 0.3833(2) 0.0748(9) Uani 1 1 d . . .
N1 N 0.19203(10) 0.10533(14) 0.19504(14) 0.0283(5) Uani 1 1 d . . .
N2 N 0.06601(13) 0.3032(2) 0.0884(2) 0.0609(12) Uani 1 1 d . . .
P1 P 0.22438(3) 0.26352(4) 0.32510(4) 0.02394(13) Uani 1 1 d . . .
P2 P 0.24431(3) 0.26213(4) 0.14316(4) 0.02507(14) Uani 1 1 d . . .
Pd1 Pd 0.236076(7) 0.263970(11) 0.235739(10) 0.02139(7) 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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 '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'
Pd Pd -0.9988 1.0072 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
0 1 0 0.1300
0 -1 0 0.1300
1 0 0 0.1000
-1 0 0 0.1000
0 0 -1 0.1300
0 0 1 0.1300
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
N1 C1 C2 110.8(2) . . y
N1 C1 Pd1 122.8(2) . . y
C2 C1 Pd1 126.5(2) . . y
C3 C2 C1 119.3(3) . . y
C3 C2 C6 132.6(3) . . y
C1 C2 C6 108.0(3) . . y
N2 C3 C2 131.3(3) . . y
C2 C6 C7 103.6(3) . . y
N1 C7 C6 104.1(2) . . y
C10 C9 C14 118.7(3) . . y
C10 C9 P1 120.9(3) . . y
C14 C9 P1 120.2(3) . . y
C9 C10 C11 119.9(4) . . y
C12 C11 C10 121.2(4) . . y
C11 C12 C13 119.2(4) . . y
C12 C13 C14 120.5(4) . . y
C13 C14 C9 120.5(4) . . y
C16 C15 C20 118.8(3) . . y
C16 C15 P1 119.4(2) . . y
C20 C15 P1 121.8(2) . . y
C15 C16 C17 120.9(3) . . y
C18 C17 C16 119.9(4) . . y
C17 C18 C19 119.8(3) . . y
C20 C19 C18 120.6(4) . . y
C19 C20 C15 119.9(4) . . y
C22 C21 C26 119.4(3) . . y
C22 C21 P1 118.6(2) . . y
C26 C21 P1 121.9(3) . . y
C21 C22 C23 120.2(4) . . y
C24 C23 C22 119.9(4) . . y
C23 C24 C25 120.8(4) . . y
C24 C25 C26 119.7(4) . . y
C25 C26 C21 120.0(3) . . y
C28 C27 C32 119.1(3) . . y
C28 C27 P2 121.3(3) . . y
C32 C27 P2 119.3(3) . . y
C27 C28 C29 120.7(4) . . y
C30 C29 C28 120.4(4) . . y
C29 C30 C31 119.9(4) . . y
C32 C31 C30 120.5(4) . . y
C31 C32 C27 119.5(4) . . y
C38 C33 C34 118.7(3) . . y
C38 C33 P2 119.2(2) . . y
C34 C33 P2 122.1(2) . . y
C35 C34 C33 120.8(4) . . y
C36 C35 C34 119.6(4) . . y
C37 C36 C35 120.5(4) . . y
C36 C37 C38 120.0(4) . . y
C37 C38 C33 120.4(3) . . y
C44 C39 C40 119.8(3) . . y
C44 C39 P2 118.0(3) . . y
C40 C39 P2 122.0(3) . . y
C41 C40 C39 119.6(4) . . y
C40 C41 C42 120.7(4) . . y
C41 C42 C43 120.1(4) . . y
C44 C43 C42 119.6(4) . . y
C43 C44 C39 120.3(4) . . y
Cl3 C45 Cl2 103.7(7) . . y
Cl4 C46 Cl5 126.6(8) . . y
Cl6 C47 Cl6 126.6(17) . 2 y
F4 B1 F3 111.4(4) . . y
F4 B1 F2 109.6(4) . . y
F3 B1 F2 109.9(4) . . y
F4 B1 F1 108.4(4) . . y
F3 B1 F1 109.2(4) . . y
F2 B1 F1 108.2(4) . . y
C1 N1 C8 126.3(3) . . y
C1 N1 C7 113.4(3) . . y
C8 N1 C7 120.3(2) . . y
C3 N2 C5 123.2(4) . . y
C3 N2 C4 120.2(4) . . y
C5 N2 C4 115.6(4) . . y
C21 P1 C15 106.84(14) . . y
C21 P1 C9 103.71(15) . . y
C15 P1 C9 105.04(15) . . y
C21 P1 Pd1 113.21(11) . . y
C15 P1 Pd1 111.63(10) . . y
C9 P1 Pd1 115.60(10) . . y
C33 P2 C39 107.93(15) . . y
C33 P2 C27 104.18(15) . . y
C39 P2 C27 103.45(15) . . y
C33 P2 Pd1 111.75(10) . . y
C39 P2 Pd1 113.29(11) . . y
C27 P2 Pd1 115.43(11) . . y
C1 Pd1 P2 89.37(9) . . y
C1 Pd1 P1 88.34(9) . . y
P2 Pd1 P1 177.54(3) . . y
C1 Pd1 Cl1 176.20(9) . . y
P2 Pd1 Cl1 90.69(3) . . y
P1 Pd1 Cl1 91.54(3) . . y
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
C1 N1 1.323(4) . y
C1 C2 1.430(4) . y
C1 Pd1 1.983(3) . y
C2 C3 1.376(5) . y
C2 C6 1.530(4) . y
C3 N2 1.335(5) . y
C4 N2 1.466(6) . y
C5 N2 1.453(7) . y
C6 C7 1.544(5) . y
C7 N1 1.476(4) . y
C8 N1 1.450(4) . y
C9 C10 1.394(5) . y
C9 C14 1.396(5) . y
C9 P1 1.831(3) . y
C10 C11 1.398(5) . y
C11 C12 1.377(7) . y
C12 C13 1.382(7) . y
C13 C14 1.396(5) . y
C15 C16 1.391(4) . y
C15 C20 1.403(5) . y
C15 P1 1.821(3) . y
C16 C17 1.398(5) . y
C17 C18 1.378(6) . y
C18 C19 1.394(7) . y
C19 C20 1.392(6) . y
C21 C22 1.392(5) . y
C21 C26 1.396(4) . y
C21 P1 1.820(3) . y
C22 C23 1.393(6) . y
C23 C24 1.378(7) . y
C24 C25 1.382(7) . y
C25 C26 1.396(5) . y
C27 C28 1.389(5) . y
C27 C32 1.409(5) . y
C27 P2 1.828(3) . y
C28 C29 1.394(6) . y
C29 C30 1.367(8) . y
C30 C31 1.399(7) . y
C31 C32 1.392(5) . y
C33 C38 1.401(4) . y
C33 C34 1.403(5) . y
C33 P2 1.816(3) . y
C34 C35 1.393(5) . y
C35 C36 1.389(7) . y
C36 C37 1.386(6) . y
C37 C38 1.395(5) . y
C39 C44 1.394(5) . y
C39 C40 1.402(5) . y
C39 P2 1.819(3) . y
C40 C41 1.385(6) . y
C41 C42 1.388(7) . y
C42 C43 1.394(7) . y
C43 C44 1.393(6) . y
C45 Cl3 1.364(11) . y
C45 Cl2 2.008(12) . y
C46 Cl4 1.481(12) . y
C46 Cl5 1.785(13) . y
C47 Cl6 1.496(10) . y
C47 Cl6 1.496(10) 2 y
B1 F4 1.380(6) . y
B1 F3 1.388(6) . y
B1 F2 1.392(5) . y
B1 F1 1.395(5) . y
Cl1 Pd1 2.3522(7) . y
P1 Pd1 2.3402(8) . y
P2 Pd1 2.3398(8) . y
