#------------------------------------------------------------------------------
#$Date: 2024-08-05 20:23:21 +0200 (Mon 05 de Aug de 2024) $
#$Revision: 293780 $
#$URL: svn://www.crystallography.net/cod/cif/7/24/89/7248938.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_7248938
loop_
_publ_author_name
'Tian, Yiming'
'Ren, Taohong'
'Zhu, Hongjin'
'Jia, Dingxian'
_publ_section_title
;
 Bromoargentate/g-C3N4 heterojunction by in situ growth: 2-D
 bromoargentate framework with a transition metal complex linker and
 cocatalyst for enhanced photocatalytic activity via g-C3N4 hybrid
;
_journal_issue                   29
_journal_name_full               CrystEngComm
_journal_page_first              3911
_journal_page_last               3919
_journal_paper_doi               10.1039/D4CE00510D
_journal_volume                  26
_journal_year                    2024
_chemical_formula_sum            'C24 H18 Ag3 Br5 Cu2 N4 O2'
_chemical_formula_weight         1244.66
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2024-04-12 deposited with the CCDC.	2024-07-02 downloaded from the CCDC.
;
_cell_angle_alpha                110.378(4)
_cell_angle_beta                 107.663(4)
_cell_angle_gamma                92.224(5)
_cell_formula_units_Z            2
_cell_length_a                   10.4752(15)
_cell_length_b                   10.9876(15)
_cell_length_c                   14.3813(19)
_cell_measurement_reflns_used    9886
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.51
_cell_measurement_theta_min      2.64
_cell_volume                     1459.0(4)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      296(2)
_diffrn_detector_area_resol_mean 14.63
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Rigaku Saturn'
_diffrn_measurement_method       ω
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1263
_diffrn_reflns_av_unetI/netI     0.0553
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            53670
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.350
_diffrn_reflns_theta_min         2.146
_exptl_absorpt_coefficient_mu    10.290
_exptl_absorpt_correction_T_max  0.4260
_exptl_absorpt_correction_T_min  0.2331
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    2.833
_exptl_crystal_description       rod
_exptl_crystal_F_000             1160
_exptl_crystal_size_max          0.300
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.100
_refine_diff_density_max         1.573
_refine_diff_density_min         -1.229
_refine_diff_density_rms         0.318
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.093
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     361
_refine_ls_number_reflns         5325
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.093
_refine_ls_R_factor_all          0.0654
_refine_ls_R_factor_gt           0.0482
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0898P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1311
_refine_ls_wR_factor_ref         0.1428
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4323
_reflns_number_total             5325
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d4ce00510d2.cif
_cod_data_source_block           a2
_cod_depositor_comments          'Adding full bibliography for 7248938.cif.'
_cod_database_code               7248938
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.233
_shelx_estimated_absorpt_t_max   0.426
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.46874(9) 0.83276(7) 0.48685(6) 0.0361(2) Uani 1 1 d . . . . .
Ag2 Ag 0.45742(8) 0.66854(7) 0.24182(6) 0.0345(2) Uani 1 1 d . . . . .
Ag3 Ag 0.50346(8) 0.52322(7) 0.40139(6) 0.0345(2) Uani 1 1 d . . . . .
Br1 Br 0.47576(11) 1.05648(8) 0.64512(7) 0.0339(3) Uani 1 1 d . . . . .
Br2 Br 0.34492(9) 0.63912(8) 0.04713(7) 0.0270(2) Uani 1 1 d . . . . .
Br3 Br 0.27407(9) 0.63143(9) 0.34385(7) 0.0270(2) Uani 1 1 d . . . . .
Br4 Br 0.65194(10) 0.52686(9) 0.28774(8) 0.0312(2) Uani 1 1 d . . . . .
Br5 Br 0.38865(9) 0.29690(8) 0.39429(7) 0.0284(2) Uani 1 1 d . . . . .
Cu1 Cu 0.38262(10) 0.98170(9) 0.79300(7) 0.0162(2) Uani 1 1 d . . . . .
Cu2 Cu 0.62064(9) 0.95863(9) 0.95302(7) 0.0160(2) Uani 1 1 d . . . . .
O1 O 0.4947(6) 0.8533(5) 0.8150(4) 0.0216(13) Uani 1 1 d . . . . .
O2 O 0.4950(5) 1.0849(5) 0.9399(4) 0.0165(12) Uani 1 1 d . . . . .
N1 N 0.2323(7) 0.8562(6) 0.6666(5) 0.0154(14) Uani 1 1 d . . . . .
N2 N 0.2523(7) 1.1087(6) 0.7801(5) 0.0163(14) Uani 1 1 d . . . . .
N3 N 0.7768(6) 1.0858(6) 1.0757(5) 0.0130(13) Uani 1 1 d . . . . .
N4 N 0.7526(7) 0.8333(7) 0.9618(5) 0.0190(15) Uani 1 1 d . . . . .
C1 C 0.2257(9) 0.7295(8) 0.6118(7) 0.0223(18) Uani 1 1 d . . . . .
H1 H 0.3014 0.6897 0.6292 0.027 Uiso 1 1 calc R U . . .
C2 C 0.1093(9) 0.6536(8) 0.5291(6) 0.0242(19) Uani 1 1 d . . . . .
H2 H 0.1094 0.5658 0.4907 0.029 Uiso 1 1 calc R U . . .
C3 C -0.0050(9) 0.7086(9) 0.5046(6) 0.0243(19) Uani 1 1 d . . . . .
H3 H -0.0836 0.6580 0.4509 0.029 Uiso 1 1 calc R U . . .
C4 C -0.0023(9) 0.8443(8) 0.5623(6) 0.0209(18) Uani 1 1 d . . . . .
C5 C -0.1138(9) 0.9127(9) 0.5427(7) 0.028(2) Uani 1 1 d . . . . .
H5 H -0.1962 0.8675 0.4910 0.033 Uiso 1 1 calc R U . . .
C6 C -0.1010(9) 1.0431(10) 0.5984(7) 0.030(2) Uani 1 1 d . . . . .
H6 H -0.1745 1.0864 0.5833 0.036 Uiso 1 1 calc R U . . .
C7 C 0.0234(8) 1.1158(8) 0.6803(6) 0.0201(18) Uani 1 1 d . . . . .
C8 C 0.0445(9) 1.2524(8) 0.7405(7) 0.0245(19) Uani 1 1 d . . . . .
H8 H -0.0247 1.3014 0.7281 0.029 Uiso 1 1 calc R U . . .
C9 C 0.1677(9) 1.3120(8) 0.8173(7) 0.0236(19) Uani 1 1 d . . . . .
H9 H 0.1827 1.4017 0.8572 0.028 Uiso 1 1 calc R U . . .
C10 C 0.2702(8) 1.2374(7) 0.8351(6) 0.0177(17) Uani 1 1 d . . . . .
H10 H 0.3536 1.2788 0.8870 0.021 Uiso 1 1 calc R U . . .
C11 C 0.1313(8) 1.0503(8) 0.7017(6) 0.0175(17) Uani 1 1 d . . . . .
C12 C 0.1191(8) 0.9112(7) 0.6406(6) 0.0176(17) Uani 1 1 d . . . . .
C13 C 0.7848(9) 1.2143(8) 1.1316(6) 0.0201(18) Uani 1 1 d . . . . .
H13 H 0.7072 1.2530 1.1194 0.024 Uiso 1 1 calc R U . . .
C14 C 0.9054(9) 1.2912(8) 1.2071(6) 0.0208(18) Uani 1 1 d . . . . .
H14 H 0.9079 1.3800 1.2444 0.025 Uiso 1 1 calc R U . . .
C15 C 1.0221(9) 1.2346(8) 1.2264(7) 0.0224(18) Uani 1 1 d . . . . .
H15 H 1.1037 1.2854 1.2757 0.027 Uiso 1 1 calc R U . . .
C16 C 1.0151(9) 1.0991(8) 1.1701(6) 0.0193(17) Uani 1 1 d . . . . .
C17 C 1.1288(9) 1.0290(8) 1.1847(6) 0.0232(19) Uani 1 1 d . . . . .
H17 H 1.2129 1.0743 1.2338 0.028 Uiso 1 1 calc R U . . .
C18 C 1.1155(8) 0.8993(8) 1.1287(6) 0.0208(18) Uani 1 1 d . . . . .
H18 H 1.1898 0.8561 1.1409 0.025 Uiso 1 1 calc R U . . .
C19 C 0.9895(9) 0.8277(8) 1.0510(6) 0.0188(17) Uani 1 1 d . . . . .
C20 C 0.9678(9) 0.6903(8) 0.9918(6) 0.0208(18) Uani 1 1 d . . . . .
H20 H 1.0378 0.6413 1.0004 0.025 Uiso 1 1 calc R U . . .
C21 C 0.8408(9) 0.6326(8) 0.9218(6) 0.0225(19) Uani 1 1 d . . . . .
H21 H 0.8244 0.5426 0.8824 0.027 Uiso 1 1 calc R U . . .
C22 C 0.7350(9) 0.7046(8) 0.9078(6) 0.0218(18) Uani 1 1 d . . . . .
H22 H 0.6499 0.6615 0.8594 0.026 Uiso 1 1 calc R U . . .
C23 C 0.8775(8) 0.8939(7) 1.0339(6) 0.0149(16) Uani 1 1 d . . . . .
C24 C 0.8915(8) 1.0312(7) 1.0947(6) 0.0136(16) 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'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Br Br -0.2901 2.4595 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 '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
Br1 Ag1 Br3 134.96(5) . . ?
Br1 Ag1 Br5 98.16(4) . 2_666 ?
Br3 Ag1 Br5 98.67(4) . 2_666 ?
Br1 Ag1 Br1 98.08(4) . 2_676 ?
Br3 Ag1 Br1 99.54(4) . 2_676 ?
Br5 Ag1 Br1 133.97(5) 2_666 2_676 ?
Br2 Ag2 Br4 118.23(4) . . ?
Br2 Ag2 Br1 105.11(4) . 2_676 ?
Br4 Ag2 Br1 116.38(4) . 2_676 ?
Br2 Ag2 Br3 114.95(4) . . ?
Br4 Ag2 Br3 105.46(4) . . ?
Br1 Ag2 Br3 94.51(3) 2_676 . ?
Br4 Ag3 Br5 121.52(4) . . ?
Br4 Ag3 Br3 110.75(4) . . ?
Br5 Ag3 Br3 99.45(4) . . ?
Br4 Ag3 Br5 113.43(4) . 2_666 ?
Br5 Ag3 Br5 111.08(3) . 2_666 ?
Br3 Ag3 Br5 96.71(3) . 2_666 ?
Br4 Ag3 Ag3 144.25(5) . 2_666 ?
Br5 Ag3 Ag3 56.75(3) . 2_666 ?
Br3 Ag3 Ag3 104.35(4) . 2_666 ?
Br5 Ag3 Ag3 54.33(3) 2_666 2_666 ?
Ag1 Br1 Ag1 81.92(3) . 2_676 ?
Ag1 Br1 Ag2 153.56(4) . 2_676 ?
Ag1 Br1 Ag2 72.72(3) 2_676 2_676 ?
Ag1 Br1 Cu1 107.03(4) . . ?
Ag1 Br1 Cu1 168.20(5) 2_676 . ?
Ag2 Br1 Cu1 99.14(4) 2_676 . ?
Ag1 Br3 Ag3 73.81(3) . . ?
Ag1 Br3 Ag2 73.63(3) . . ?
Ag3 Br3 Ag2 68.79(3) . . ?
Ag3 Br4 Ag2 73.85(3) . . ?
Ag3 Br5 Ag1 120.79(4) . 2_666 ?
Ag3 Br5 Ag3 68.92(3) . 2_666 ?
Ag1 Br5 Ag3 72.98(3) 2_666 2_666 ?
O1 Cu1 O2 82.2(2) . . ?
O1 Cu1 N2 172.7(3) . . ?
O2 Cu1 N2 96.3(2) . . ?
O1 Cu1 N1 96.6(2) . . ?
O2 Cu1 N1 161.3(2) . . ?
N2 Cu1 N1 82.5(3) . . ?
O1 Cu1 Br1 101.74(18) . . ?
O2 Cu1 Br1 111.69(16) . . ?
N2 Cu1 Br1 85.48(19) . . ?
N1 Cu1 Br1 86.87(18) . . ?
O1 Cu2 O2 81.9(2) . . ?
O1 Cu2 N4 97.6(2) . . ?
O2 Cu2 N4 177.0(3) . . ?
O1 Cu2 N3 164.9(3) . . ?
O2 Cu2 N3 97.6(2) . . ?
N4 Cu2 N3 82.1(3) . . ?
O1 Cu2 O2 100.1(2) . 2_677 ?
O2 Cu2 O2 84.5(2) . 2_677 ?
N4 Cu2 O2 98.5(2) . 2_677 ?
N3 Cu2 O2 94.9(2) . 2_677 ?
Cu1 O1 Cu2 99.0(2) . . ?
Cu1 O2 Cu2 96.2(2) . . ?
Cu1 O2 Cu2 106.5(2) . 2_677 ?
Cu2 O2 Cu2 95.5(2) . 2_677 ?
C1 N1 C12 117.5(7) . . ?
C1 N1 Cu1 129.6(6) . . ?
C12 N1 Cu1 112.7(5) . . ?
C10 N2 C11 118.4(7) . . ?
C10 N2 Cu1 129.1(6) . . ?
C11 N2 Cu1 112.5(5) . . ?
C13 N3 C24 117.9(7) . . ?
C13 N3 Cu2 129.5(5) . . ?
C24 N3 Cu2 112.2(5) . . ?
C22 N4 C23 118.1(7) . . ?
C22 N4 Cu2 129.4(6) . . ?
C23 N4 Cu2 112.5(5) . . ?
N1 C1 C2 122.4(8) . . ?
N1 C1 H1 118.8 . . ?
C2 C1 H1 118.8 . . ?
C3 C2 C1 119.9(8) . . ?
C3 C2 H2 120.1 . . ?
C1 C2 H2 120.1 . . ?
C2 C3 C4 119.4(8) . . ?
C2 C3 H3 120.3 . . ?
C4 C3 H3 120.3 . . ?
C12 C4 C5 119.5(8) . . ?
C12 C4 C3 116.0(8) . . ?
C5 C4 C3 124.4(8) . . ?
C6 C5 C4 120.6(8) . . ?
C6 C5 H5 119.7 . . ?
C4 C5 H5 119.7 . . ?
C5 C6 C7 121.4(8) . . ?
C5 C6 H6 119.3 . . ?
C7 C6 H6 119.3 . . ?
C11 C7 C8 117.0(8) . . ?
C11 C7 C6 118.6(8) . . ?
C8 C7 C6 124.4(8) . . ?
C9 C8 C7 119.5(7) . . ?
C9 C8 H8 120.3 . . ?
C7 C8 H8 120.3 . . ?
C8 C9 C10 119.6(8) . . ?
C8 C9 H9 120.2 . . ?
C10 C9 H9 120.2 . . ?
N2 C10 C9 122.0(8) . . ?
N2 C10 H10 119.0 . . ?
C9 C10 H10 119.0 . . ?
N2 C11 C7 123.4(7) . . ?
N2 C11 C12 116.3(7) . . ?
C7 C11 C12 120.2(8) . . ?
N1 C12 C4 124.7(7) . . ?
N1 C12 C11 115.7(7) . . ?
C4 C12 C11 119.6(7) . . ?
N3 C13 C14 122.1(8) . . ?
N3 C13 H13 118.9 . . ?
C14 C13 H13 118.9 . . ?
C15 C14 C13 119.6(8) . . ?
C15 C14 H14 120.2 . . ?
C13 C14 H14 120.2 . . ?
C14 C15 C16 119.1(8) . . ?
C14 C15 H15 120.4 . . ?
C16 C15 H15 120.4 . . ?
C24 C16 C15 117.1(8) . . ?
C24 C16 C17 118.7(7) . . ?
C15 C16 C17 124.1(8) . . ?
C18 C17 C16 121.3(8) . . ?
C18 C17 H17 119.3 . . ?
C16 C17 H17 119.3 . . ?
C17 C18 C19 120.9(8) . . ?
C17 C18 H18 119.6 . . ?
C19 C18 H18 119.6 . . ?
C23 C19 C20 117.4(7) . . ?
C23 C19 C18 119.0(7) . . ?
C20 C19 C18 123.5(7) . . ?
C21 C20 C19 117.7(7) . . ?
C21 C20 H20 121.1 . . ?
C19 C20 H20 121.1 . . ?
C20 C21 C22 121.8(7) . . ?
C20 C21 H21 119.1 . . ?
C22 C21 H21 119.1 . . ?
N4 C22 C21 121.7(8) . . ?
N4 C22 H22 119.2 . . ?
C21 C22 H22 119.2 . . ?
N4 C23 C19 123.2(7) . . ?
N4 C23 C24 116.9(7) . . ?
C19 C23 C24 119.9(7) . . ?
N3 C24 C16 124.0(7) . . ?
N3 C24 C23 115.8(7) . . ?
C16 C24 C23 120.1(7) . . ?
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
Ag1 Br1 2.6864(11) . ?
Ag1 Br3 2.6866(12) . ?
Ag1 Br5 2.7377(12) 2_666 ?
Ag1 Br1 2.7649(12) 2_676 ?
Ag2 Br2 2.5827(11) . ?
Ag2 Br4 2.6753(12) . ?
Ag2 Br1 2.8261(12) 2_676 ?
Ag2 Br3 2.8415(13) . ?
Ag3 Br4 2.5837(12) . ?
Ag3 Br5 2.6753(12) . ?
Ag3 Br3 2.7517(12) . ?
Ag3 Br5 2.7540(12) 2_666 ?
Ag3 Ag3 3.0726(15) 2_666 ?
Br1 Ag1 2.7649(12) 2_676 ?
Br1 Ag2 2.8260(12) 2_676 ?
Br1 Cu1 2.9264(13) . ?
Br5 Ag1 2.7377(12) 2_666 ?
Br5 Ag3 2.7540(12) 2_666 ?
Cu1 O1 1.919(5) . ?
Cu1 O2 1.963(5) . ?
Cu1 N2 2.005(6) . ?
Cu1 N1 2.009(7) . ?
Cu2 O1 1.927(5) . ?
Cu2 O2 1.966(5) . ?
Cu2 N4 1.996(7) . ?
Cu2 N3 2.024(6) . ?
Cu2 O2 2.381(5) 2_677 ?
O2 Cu2 2.381(5) 2_677 ?
N1 C1 1.326(10) . ?
N1 C12 1.362(10) . ?
N2 C10 1.331(10) . ?
N2 C11 1.363(10) . ?
N3 C13 1.344(10) . ?
N3 C24 1.360(10) . ?
N4 C22 1.329(10) . ?
N4 C23 1.363(10) . ?
C1 C2 1.396(12) . ?
C1 H1 0.9300 . ?
C2 C3 1.367(13) . ?
C2 H2 0.9300 . ?
C3 C4 1.426(12) . ?
C3 H3 0.9300 . ?
C4 C12 1.381(11) . ?
C4 C5 1.423(12) . ?
C5 C6 1.354(13) . ?
C5 H5 0.9300 . ?
C6 C7 1.434(12) . ?
C6 H6 0.9300 . ?
C7 C11 1.377(11) . ?
C7 C8 1.416(12) . ?
C8 C9 1.370(12) . ?
C8 H8 0.9300 . ?
C9 C10 1.392(11) . ?
C9 H9 0.9300 . ?
C10 H10 0.9300 . ?
C11 C12 1.451(11) . ?
C13 C14 1.391(12) . ?
C13 H13 0.9300 . ?
C14 C15 1.390(12) . ?
C14 H14 0.9300 . ?
C15 C16 1.412(11) . ?
C15 H15 0.9300 . ?
C16 C24 1.385(11) . ?
C16 C17 1.445(12) . ?
C17 C18 1.348(12) . ?
C17 H17 0.9300 . ?
C18 C19 1.423(11) . ?
C18 H18 0.9300 . ?
C19 C23 1.407(11) . ?
C19 C20 1.420(11) . ?
C20 C21 1.365(12) . ?
C20 H20 0.9300 . ?
C21 C22 1.392(12) . ?
C21 H21 0.9300 . ?
C22 H22 0.9300 . ?
C23 C24 1.431(11) . ?
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
C12 N1 C1 C2 1.1(12) . . . . ?
Cu1 N1 C1 C2 175.9(6) . . . . ?
N1 C1 C2 C3 -2.4(13) . . . . ?
C1 C2 C3 C4 1.8(13) . . . . ?
C2 C3 C4 C12 0.0(12) . . . . ?
C2 C3 C4 C5 178.7(8) . . . . ?
C12 C4 C5 C6 1.3(13) . . . . ?
C3 C4 C5 C6 -177.3(9) . . . . ?
C4 C5 C6 C7 -1.4(14) . . . . ?
C5 C6 C7 C11 0.1(13) . . . . ?
C5 C6 C7 C8 179.0(8) . . . . ?
C11 C7 C8 C9 -1.2(12) . . . . ?
C6 C7 C8 C9 179.8(8) . . . . ?
C7 C8 C9 C10 -0.2(13) . . . . ?
C11 N2 C10 C9 2.4(11) . . . . ?
Cu1 N2 C10 C9 -179.0(6) . . . . ?
C8 C9 C10 N2 -0.4(13) . . . . ?
C10 N2 C11 C7 -3.9(12) . . . . ?
Cu1 N2 C11 C7 177.2(6) . . . . ?
C10 N2 C11 C12 177.1(7) . . . . ?
Cu1 N2 C11 C12 -1.8(9) . . . . ?
C8 C7 C11 N2 3.4(12) . . . . ?
C6 C7 C11 N2 -177.6(7) . . . . ?
C8 C7 C11 C12 -177.7(7) . . . . ?
C6 C7 C11 C12 1.3(12) . . . . ?
C1 N1 C12 C4 0.9(11) . . . . ?
Cu1 N1 C12 C4 -174.8(6) . . . . ?
C1 N1 C12 C11 -179.3(7) . . . . ?
Cu1 N1 C12 C11 5.0(8) . . . . ?
C5 C4 C12 N1 179.8(8) . . . . ?
C3 C4 C12 N1 -1.4(12) . . . . ?
C5 C4 C12 C11 0.1(12) . . . . ?
C3 C4 C12 C11 178.8(7) . . . . ?
N2 C11 C12 N1 -2.1(10) . . . . ?
C7 C11 C12 N1 178.8(7) . . . . ?
N2 C11 C12 C4 177.6(7) . . . . ?
C7 C11 C12 C4 -1.4(12) . . . . ?
C24 N3 C13 C14 -0.1(11) . . . . ?
Cu2 N3 C13 C14 -173.2(6) . . . . ?
N3 C13 C14 C15 -0.2(12) . . . . ?
C13 C14 C15 C16 -1.2(12) . . . . ?
C14 C15 C16 C24 2.8(12) . . . . ?
C14 C15 C16 C17 -178.9(8) . . . . ?
C24 C16 C17 C18 -1.8(12) . . . . ?
C15 C16 C17 C18 179.9(8) . . . . ?
C16 C17 C18 C19 1.7(13) . . . . ?
C17 C18 C19 C23 -0.7(12) . . . . ?
C17 C18 C19 C20 -177.9(8) . . . . ?
C23 C19 C20 C21 0.8(11) . . . . ?
C18 C19 C20 C21 178.1(8) . . . . ?
C19 C20 C21 C22 0.2(12) . . . . ?
C23 N4 C22 C21 -1.4(12) . . . . ?
Cu2 N4 C22 C21 177.8(6) . . . . ?
C20 C21 C22 N4 0.1(13) . . . . ?
C22 N4 C23 C19 2.5(11) . . . . ?
Cu2 N4 C23 C19 -176.9(6) . . . . ?
C22 N4 C23 C24 -176.9(7) . . . . ?
Cu2 N4 C23 C24 3.8(8) . . . . ?
C20 C19 C23 N4 -2.2(11) . . . . ?
C18 C19 C23 N4 -179.6(7) . . . . ?
C20 C19 C23 C24 177.1(7) . . . . ?
C18 C19 C23 C24 -0.2(11) . . . . ?
C13 N3 C24 C16 1.8(11) . . . . ?
Cu2 N3 C24 C16 176.1(6) . . . . ?
C13 N3 C24 C23 179.4(6) . . . . ?
Cu2 N3 C24 C23 -6.3(8) . . . . ?
C15 C16 C24 N3 -3.2(11) . . . . ?
C17 C16 C24 N3 178.4(7) . . . . ?
C15 C16 C24 C23 179.3(7) . . . . ?
C17 C16 C24 C23 0.9(11) . . . . ?
N4 C23 C24 N3 1.8(10) . . . . ?
C19 C23 C24 N3 -177.6(7) . . . . ?
N4 C23 C24 C16 179.5(7) . . . . ?
C19 C23 C24 C16 0.1(11) . . . . ?
