#------------------------------------------------------------------------------
#$Date: 2019-10-28 09:57:03 +0200 (Mon, 28 Oct 2019) $
#$Revision: 219862 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/51/46/4514685.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_4514685
loop_
_publ_author_name
'Zhu, Jiancheng'
'Lindsay, Vincent N. G.'
_publ_section_title
;
 Benzimidazolyl Palladium Complexes as Highly Active and General
 Bifunctional Catalysts in Sustainable Cross-Coupling Reactions
;
_journal_issue                   8
_journal_name_full               'ACS Catalysis'
_journal_page_first              6993
_journal_paper_doi               10.1021/acscatal.9b02420
_journal_volume                  9
_journal_year                    2019
_chemical_formula_moiety         'C36 H30 N8 Pd2, 2(F6 P),3(C3 H6 O)'
_chemical_formula_sum            'C45 H48 F12 N8 O3 P2 Pd2'
_chemical_formula_weight         1251.65
_chemical_name_common            JZ-I-126B
_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'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_cell_angle_alpha                90
_cell_angle_beta                 108.4539(17)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   25.202(2)
_cell_length_b                   8.3844(7)
_cell_length_c                   24.157(2)
_cell_measurement_reflns_used    2576
_cell_measurement_temperature    100.(2)
_cell_measurement_theta_max      35.4803
_cell_measurement_theta_min      1.7924
_cell_volume                     4842.0(7)
_computing_cell_refinement       'APEX3 v2017.3-0 (Bruker AXS)'
_computing_data_collection       'Bruker Instrument Service v2013.12.0.0'
_computing_data_reduction        'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_molecular_graphics    'shelXle (C.B. Huebschle, rev 833)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_diffrn_ambient_temperature      100.(2)
_diffrn_detector_area_resol_mean 8.3333
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker-Nonius X8 Kappa APEX II'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0525
_diffrn_reflns_av_unetI/netI     0.0359
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_h_min       -36
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       34
_diffrn_reflns_limit_l_min       -34
_diffrn_reflns_number            44453
_diffrn_reflns_theta_full        30.51
_diffrn_reflns_theta_max         30.51
_diffrn_reflns_theta_min         1.78
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    0.905
_exptl_absorpt_correction_T_max  0.75
_exptl_absorpt_correction_T_min  0.69
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.717
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2512
_exptl_crystal_size_max          0.203
_exptl_crystal_size_mid          0.157
_exptl_crystal_size_min          0.119
_refine_diff_density_max         1.221
_refine_diff_density_min         -1.480
_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     324
_refine_ls_number_reflns         7361
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      1.070
_refine_ls_R_factor_all          0.0467
_refine_ls_R_factor_gt           0.0318
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0314P)²+12.0771P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0748
_refine_ls_wR_factor_ref         0.0817
_reflns_number_gt                5935
_reflns_number_total             7361
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            cs9b02420_si_001.cif
_cod_data_source_block           S1066
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-Scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/current/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_database_code               4514685
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_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_refinement_flags_posn
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pd Pd1 0.54078(2) 0.16263(2) 0.70544(2) 0.01216(5) Uani d . . . 1 . .
N N1 0.56160(8) 0.2902(2) 0.77958(8) 0.0143(4) Uani d . . . 1 . .
N N2 0.55332(9) 0.3764(2) 0.86258(9) 0.0167(4) Uani d . . . 1 . .
N N3 0.61398(8) 0.0303(3) 0.72402(9) 0.0200(4) Uani d . . . 1 . .
N N4 0.52098(8) 0.0165(2) 0.63498(8) 0.0157(4) Uani d . . . 1 . .
C C1 0.52994(9) 0.2841(3) 0.81499(10) 0.0130(4) Uani d . . . 1 . .
C C2 0.60658(10) 0.3914(3) 0.80462(11) 0.0188(5) Uani d . . . 1 . .
C C3 0.65077(11) 0.4411(3) 0.78581(12) 0.0255(5) Uani d . . . 1 . .
H H3 0.653941 0.407395 0.74945 0.031 Uiso calc U . R 1 . .
C C4 0.68982(12) 0.5419(4) 0.82243(13) 0.0350(7) Uani d . . . 1 . .
H H4 0.720821 0.576489 0.811191 0.042 Uiso calc U . R 1 . .
C C5 0.68486(14) 0.5941(4) 0.87555(14) 0.0403(8) Uani d . . . 1 . .
H H5 0.712561 0.663372 0.899434 0.048 Uiso calc U . R 1 . .
C C6 0.64066(13) 0.5475(4) 0.89425(13) 0.0343(7) Uani d . . . 1 . .
H H6 0.637129 0.583806 0.930172 0.041 Uiso calc U . R 1 . .
C C7 0.60166(11) 0.4448(3) 0.85773(11) 0.0224(5) Uani d . . . 1 . .
C C8 0.53076(12) 0.4077(3) 0.90985(12) 0.0262(6) Uani d . . . 1 . .
H H8A 0.495751 0.348469 0.903077 0.039 Uiso calc U . R 1 . .
H H8B 0.523522 0.522127 0.911497 0.039 Uiso calc U . R 1 . .
H H8C 0.557789 0.373548 0.946886 0.039 Uiso calc U . R 1 . .
C C9 0.65866(11) 0.0406(3) 0.77196(12) 0.0263(5) Uani d . . . 1 . .
H H9 0.657185 0.109986 0.80254 0.032 Uiso calc U . R 1 . .
C C10 0.70682(12) -0.0461(4) 0.77848(14) 0.0335(7) Uani d . . . 1 . .
H H10 0.738064 -0.036507 0.812872 0.04 Uiso calc U . R 1 . .
C C11 0.70862(12) -0.1470(4) 0.73404(14) 0.0359(7) Uani d . . . 1 . .
H H11 0.741666 -0.205724 0.737089 0.043 Uiso calc U . R 1 . .
C C12 0.66224(12) -0.1624(3) 0.68510(13) 0.0287(6) Uani d . . . 1 . .
H H12 0.662573 -0.233878 0.654688 0.034 Uiso calc U . R 1 . .
C C13 0.61517(10) -0.0717(3) 0.68111(11) 0.0199(5) Uani d . . . 1 . .
C C14 0.56271(11) -0.0824(3) 0.63197(11) 0.0184(5) Uani d . . . 1 . .
C C15 0.55435(12) -0.1901(3) 0.58643(12) 0.0248(5) Uani d . . . 1 . .
H H15 0.583857 -0.258438 0.584696 0.03 Uiso calc U . R 1 . .
C C16 0.50281(13) -0.1974(3) 0.54359(12) 0.0268(6) Uani d . . . 1 . .
H H16 0.496768 -0.26963 0.511873 0.032 Uiso calc U . R 1 . .
C C17 0.46006(12) -0.0985(3) 0.54735(11) 0.0239(5) Uani d . . . 1 . .
H H17 0.424116 -0.102846 0.518776 0.029 Uiso calc U . R 1 . .
C C18 0.47094(11) 0.0069(3) 0.59372(10) 0.0199(5) Uani d . . . 1 . .
H H18 0.441754 0.075183 0.596383 0.024 Uiso calc U . R 1 . .
P P2 0.63850(3) 0.35910(7) 0.59328(3) 0.02000(13) Uani d . . . 1 . .
F F1 0.61251(8) 0.4340(2) 0.63961(8) 0.0406(4) Uani d . . . 1 . .
F F2 0.66409(10) 0.2861(3) 0.54665(10) 0.0555(6) Uani d . . . 1 . .
F F3 0.67990(9) 0.5093(2) 0.60267(8) 0.0435(5) Uani d . . . 1 . .
F F4 0.59688(7) 0.21056(18) 0.58392(7) 0.0275(3) Uani d . . . 1 . .
F F5 0.59309(9) 0.4532(2) 0.54238(8) 0.0461(5) Uani d . . . 1 . .
F F6 0.68344(8) 0.2658(2) 0.64464(9) 0.0467(5) Uani d . . . 1 . .
O O1S 0.34983(12) 0.1568(4) 0.56407(19) 0.0897(13) Uani d . . . 1 . .
C C1S 0.31536(13) 0.0962(4) 0.52317(19) 0.0455(9) Uani d . . . 1 . .
C C2S 0.2767(2) -0.0258(5) 0.53227(17) 0.0659(13) Uani d . . . 1 . .
H H2SA 0.281159 -0.124737 0.512593 0.099 Uiso calc U . R 1 . .
H H2SB 0.238144 0.012307 0.516115 0.099 Uiso calc U . R 1 . .
H H2SC 0.285298 -0.045889 0.574152 0.099 Uiso calc U . R 1 . .
C C3S 0.3091(2) 0.1392(6) 0.4619(3) 0.0834(17) Uani d . . . 1 . .
H H3SA 0.2697 0.161618 0.440926 0.125 Uiso calc U . R 1 . .
H H3SB 0.321885 0.050299 0.44303 0.125 Uiso calc U . R 1 . .
H H3SC 0.331631 0.23408 0.461313 0.125 Uiso calc U . R 1 . .
O O2S 0.5264(2) 0.6609(6) 0.7016(2) 0.0625(11) Uani d . P G 0.5 A -1
C C4S 0.5074(2) 0.7301(4) 0.7350(2) 0.0625(11) Uani d . P G 0.5 A -1
C C5S 0.4468(2) 0.7791(11) 0.7178(4) 0.0625(11) Uani d . P G 0.5 A -1
H H5SA 0.443755 0.894532 0.711031 0.094 Uiso calc U P R 0.5 A -1
H H5SB 0.43151 0.751436 0.749121 0.094 Uiso calc U P R 0.5 A -1
H H5SC 0.425649 0.723289 0.681918 0.094 Uiso calc U P R 0.5 A -1
C C6S 0.5431(3) 0.7724(11) 0.7962(3) 0.0625(11) Uani d . P G 0.5 A -1
H H6SA 0.581038 0.731006 0.803216 0.094 Uiso calc U P R 0.5 A -1
H H6SB 0.526902 0.724976 0.824253 0.094 Uiso calc U P R 0.5 A -1
H H6SC 0.544525 0.888583 0.800745 0.094 Uiso calc U P R 0.5 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 0.0033 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'
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'
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'
Pd Pd -0.9988 1.0072 '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
C1 Pd1 N1 2_656 . 84.75(8)
C1 Pd1 N4 2_656 . 98.00(8)
N1 Pd1 N4 . . 175.01(8)
C1 Pd1 N3 2_656 . 177.88(9)
N1 Pd1 N3 . . 97.37(8)
N4 Pd1 N3 . . 79.89(8)
C1 N1 C2 . . 108.23(19)
C1 N1 Pd1 . . 120.51(15)
C2 N1 Pd1 . . 131.25(16)
C1 N2 C7 . . 108.8(2)
C1 N2 C8 . . 126.6(2)
C7 N2 C8 . . 124.5(2)
C9 N3 C13 . . 119.2(2)
C9 N3 Pd1 . . 126.82(18)
C13 N3 Pd1 . . 113.97(16)
C18 N4 C14 . . 119.0(2)
C18 N4 Pd1 . . 125.78(16)
C14 N4 Pd1 . . 115.14(16)
N1 C1 N2 . . 109.39(19)
N1 C1 Pd1 . 2_656 122.12(16)
N2 C1 Pd1 . 2_656 128.44(17)
N1 C2 C3 . . 131.8(2)
N1 C2 C7 . . 107.3(2)
C3 C2 C7 . . 121.0(2)
C4 C3 C2 . . 117.0(3)
C4 C3 H3 . . 121.5
C2 C3 H3 . . 121.5
C3 C4 C5 . . 121.7(3)
C3 C4 H4 . . 119.1
C5 C4 H4 . . 119.1
C6 C5 C4 . . 121.7(3)
C6 C5 H5 . . 119.1
C4 C5 H5 . . 119.1
C5 C6 C7 . . 116.6(3)
C5 C6 H6 . . 121.7
C7 C6 H6 . . 121.7
N2 C7 C6 . . 131.8(3)
N2 C7 C2 . . 106.3(2)
C6 C7 C2 . . 121.9(2)
N2 C8 H8A . . 109.5
N2 C8 H8B . . 109.5
H8A C8 H8B . . 109.5
N2 C8 H8C . . 109.5
H8A C8 H8C . . 109.5
H8B C8 H8C . . 109.5
N3 C9 C10 . . 122.2(3)
N3 C9 H9 . . 118.9
C10 C9 H9 . . 118.9
C11 C10 C9 . . 118.6(3)
C11 C10 H10 . . 120.7
C9 C10 H10 . . 120.7
C10 C11 C12 . . 119.8(3)
C10 C11 H11 . . 120.1
C12 C11 H11 . . 120.1
C11 C12 C13 . . 118.8(3)
C11 C12 H12 . . 120.6
C13 C12 H12 . . 120.6
N3 C13 C12 . . 121.3(3)
N3 C13 C14 . . 115.1(2)
C12 C13 C14 . . 123.5(2)
N4 C14 C15 . . 120.9(2)
N4 C14 C13 . . 115.6(2)
C15 C14 C13 . . 123.4(2)
C16 C15 C14 . . 119.6(2)
C16 C15 H15 . . 120.2
C14 C15 H15 . . 120.2
C15 C16 C17 . . 119.3(2)
C15 C16 H16 . . 120.3
C17 C16 H16 . . 120.3
C18 C17 C16 . . 118.5(3)
C18 C17 H17 . . 120.8
C16 C17 H17 . . 120.8
N4 C18 C17 . . 122.6(2)
N4 C18 H18 . . 118.7
C17 C18 H18 . . 118.7
F2 P2 F1 . . 179.35(14)
F2 P2 F6 . . 90.86(13)
F1 P2 F6 . . 89.74(12)
F2 P2 F4 . . 89.73(10)
F1 P2 F4 . . 90.52(10)
F6 P2 F4 . . 90.03(9)
F2 P2 F5 . . 89.84(13)
F1 P2 F5 . . 89.56(11)
F6 P2 F5 . . 179.29(13)
F4 P2 F5 . . 89.87(10)
F2 P2 F3 . . 90.62(11)
F1 P2 F3 . . 89.13(11)
F6 P2 F3 . . 90.29(11)
F4 P2 F3 . . 179.53(11)
F5 P2 F3 . . 89.81(11)
O1S C1S C2S . . 120.6(4)
O1S C1S C3S . . 122.6(4)
C2S C1S C3S . . 116.8(4)
C1S C2S H2SA . . 109.5
C1S C2S H2SB . . 109.5
H2SA C2S H2SB . . 109.5
C1S C2S H2SC . . 109.5
H2SA C2S H2SC . . 109.5
H2SB C2S H2SC . . 109.5
C1S C3S H3SA . . 109.5
C1S C3S H3SB . . 109.5
H3SA C3S H3SB . . 109.5
C1S C3S H3SC . . 109.5
H3SA C3S H3SC . . 109.5
H3SB C3S H3SC . . 109.5
O2S C4S C6S . . 121.8
O2S C4S C5S . . 121.8
C6S C4S C5S . . 116.4
C4S C5S H5SA . . 109.5
C4S C5S H5SB . . 109.5
H5SA C5S H5SB . . 109.5
C4S C5S H5SC . . 109.5
H5SA C5S H5SC . . 109.5
H5SB C5S H5SC . . 109.5
C4S C6S H6SA . . 109.5
C4S C6S H6SB . . 109.5
H6SA C6S H6SB . . 109.5
C4S C6S H6SC . . 109.5
H6SA C6S H6SC . . 109.5
H6SB C6S H6SC . . 109.5
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Pd1 C1 2_656 1.975(2)
Pd1 N1 . 2.0080(19)
Pd1 N4 . 2.0269(19)
Pd1 N3 . 2.076(2)
N1 C1 . 1.343(3)
N1 C2 . 1.392(3)
N2 C1 . 1.356(3)
N2 C7 . 1.385(3)
N2 C8 . 1.451(3)
N3 C9 . 1.338(3)
N3 C13 . 1.352(3)
N4 C18 . 1.340(3)
N4 C14 . 1.359(3)
C2 C3 . 1.393(3)
C2 C7 . 1.401(4)
C3 C4 . 1.383(4)
C3 H3 . 0.95
C4 C5 . 1.398(5)
C4 H4 . 0.95
C5 C6 . 1.384(4)
C5 H5 . 0.95
C6 C7 . 1.392(4)
C6 H6 . 0.95
C8 H8A . 0.98
C8 H8B . 0.98
C8 H8C . 0.98
C9 C10 . 1.381(4)
C9 H9 . 0.95
C10 C11 . 1.379(5)
C10 H10 . 0.95
C11 C12 . 1.381(4)
C11 H11 . 0.95
C12 C13 . 1.387(3)
C12 H12 . 0.95
C13 C14 . 1.474(4)
C14 C15 . 1.387(3)
C15 C16 . 1.382(4)
C15 H15 . 0.95
C16 C17 . 1.386(4)
C16 H16 . 0.95
C17 C18 . 1.384(3)
C17 H17 . 0.95
C18 H18 . 0.95
P2 F2 . 1.587(2)
P2 F1 . 1.5938(18)
P2 F6 . 1.5952(19)
P2 F4 . 1.5977(16)
P2 F5 . 1.5977(19)
P2 F3 . 1.6049(17)
O1S C1S . 1.202(5)
C1S C2S . 1.475(5)
C1S C3S . 1.482(6)
C2S H2SA . 0.98
C2S H2SB . 0.98
C2S H2SC . 0.98
C3S H3SA . 0.98
C3S H3SB . 0.98
C3S H3SC . 0.98
O2S C4S . 1.208
C4S C6S . 1.5084
C4S C5S . 1.5087
C5S H5SA . 0.98
C5S H5SB . 0.98
C5S H5SC . 0.98
C6S H6SA . 0.98
C6S H6SB . 0.98
C6S H6SC . 0.98
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
C2 N1 C1 N2 . -0.8(3)
Pd1 N1 C1 N2 . 178.34(14)
C2 N1 C1 Pd1 2_656 176.81(16)
Pd1 N1 C1 Pd1 2_656 -4.0(2)
C7 N2 C1 N1 . 0.2(3)
C8 N2 C1 N1 . 177.0(2)
C7 N2 C1 Pd1 2_656 -177.26(18)
C8 N2 C1 Pd1 2_656 -0.5(3)
C1 N1 C2 C3 . -178.7(3)
Pd1 N1 C2 C3 . 2.3(4)
C1 N1 C2 C7 . 1.1(3)
Pd1 N1 C2 C7 . -177.89(17)
N1 C2 C3 C4 . -178.8(3)
C7 C2 C3 C4 . 1.5(4)
C2 C3 C4 C5 . -1.1(5)
C3 C4 C5 C6 . 0.1(6)
C4 C5 C6 C7 . 0.6(5)
C1 N2 C7 C6 . -179.9(3)
C8 N2 C7 C6 . 3.3(5)
C1 N2 C7 C2 . 0.5(3)
C8 N2 C7 C2 . -176.3(2)
C5 C6 C7 N2 . -179.8(3)
C5 C6 C7 C2 . -0.2(5)
N1 C2 C7 N2 . -1.0(3)
C3 C2 C7 N2 . 178.8(2)
N1 C2 C7 C6 . 179.3(3)
C3 C2 C7 C6 . -0.8(4)
C13 N3 C9 C10 . 2.0(4)
Pd1 N3 C9 C10 . -175.9(2)
N3 C9 C10 C11 . -0.2(4)
C9 C10 C11 C12 . -1.7(4)
C10 C11 C12 C13 . 1.9(4)
C9 N3 C13 C12 . -1.8(4)
Pd1 N3 C13 C12 . 176.30(19)
C9 N3 C13 C14 . 176.1(2)
Pd1 N3 C13 C14 . -5.8(3)
C11 C12 C13 N3 . -0.1(4)
C11 C12 C13 C14 . -177.8(2)
C18 N4 C14 C15 . 1.2(3)
Pd1 N4 C14 C15 . 178.98(18)
C18 N4 C14 C13 . -176.0(2)
Pd1 N4 C14 C13 . 1.8(3)
N3 C13 C14 N4 . 2.8(3)
C12 C13 C14 N4 . -179.4(2)
N3 C13 C14 C15 . -174.3(2)
C12 C13 C14 C15 . 3.5(4)
N4 C14 C15 C16 . -0.2(4)
C13 C14 C15 C16 . 176.8(2)
C14 C15 C16 C17 . -0.9(4)
C15 C16 C17 C18 . 1.1(4)
C14 N4 C18 C17 . -1.0(4)
Pd1 N4 C18 C17 . -178.53(18)
C16 C17 C18 N4 . -0.2(4)
