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#$Date: 2024-08-05 22:48:41 +0300 (Mon, 05 Aug 2024) $
#$Revision: 293909 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/06/32/7063233.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_7063233
loop_
_publ_author_name
'Moussa, J.'
'Gontard, G.'
_publ_section_title
;
 Novel heteroleptic copper(i) complexes merging the chelating
 1,2-bis-diphenyldiphosphine and various L^X type coligands
;
_journal_issue                   27
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              12162
_journal_page_last               12165
_journal_paper_doi               10.1039/D3NJ05212E
_journal_volume                  48
_journal_year                    2024
_chemical_formula_moiety         'C37 H30 Cu N O2 P2'
_chemical_formula_sum            'C37 H30 Cu N O2 P2'
_chemical_formula_weight         646.10
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2019-07-25 deposited with the CCDC.	2024-05-21 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 94.867(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.3072(2)
_cell_length_b                   18.5057(4)
_cell_length_c                   19.9706(4)
_cell_measurement_reflns_used    8399
_cell_measurement_temperature    200(1)
_cell_measurement_theta_max      67.74
_cell_measurement_theta_min      4.78
_cell_volume                     3059.02(12)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'DIAMOND (Brandenburg, 2006)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SIR-97 (Altomare et al., 1999)'
_diffrn_ambient_temperature      200(1)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  'multi layer miror'
_diffrn_radiation_source         'microfocus sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0318
_diffrn_reflns_av_unetI/netI     0.0275
_diffrn_reflns_Laue_measured_fraction_full 0.990
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            26598
_diffrn_reflns_point_group_measured_fraction_full 0.990
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         68.525
_diffrn_reflns_theta_min         3.261
_exptl_absorpt_coefficient_mu    2.270
_exptl_absorpt_correction_T_max  0.753
_exptl_absorpt_correction_T_min  0.682
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS, Bruker AXS Inc., Madison, 
Wisconsin, USA. 
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.403
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1336
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.03
_exptl_crystal_size_min          0.02
_refine_diff_density_max         0.291
_refine_diff_density_min         -0.300
_refine_diff_density_rms         0.047
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     389
_refine_ls_number_reflns         5504
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.020
_refine_ls_R_factor_all          0.0392
_refine_ls_R_factor_gt           0.0299
_refine_ls_shift/su_max          0.023
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0363P)²+1.4383P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0725
_refine_ls_wR_factor_ref         0.0767
_reflns_number_gt                4645
_reflns_number_total             5504
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3nj05212e2.cif
_cod_data_source_block           jmy-14-2
_cod_depositor_comments
'Adding full bibliography for 7063232--7063233.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7063233
_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.
;
_shelxl_version_number           2013-4
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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_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
Cu1 Cu 0.59934(3) 0.28780(2) 0.26811(2) 0.02409(9) Uani 1 1 d . . . . .
P1 P 0.50039(6) 0.31944(3) 0.16482(2) 0.02241(11) Uani 1 1 d . . . . .
P2 P 0.52111(5) 0.39416(2) 0.30900(2) 0.02080(11) Uani 1 1 d . . . . .
O1 O 0.49634(16) 0.20231(7) 0.31429(8) 0.0317(3) Uani 1 1 d . . . . .
O2 O 0.5658(2) 0.11996(9) 0.39352(8) 0.0495(4) Uani 1 1 d . . . . .
N1 N 0.80600(18) 0.23616(8) 0.30288(8) 0.0224(3) Uani 1 1 d . . . . .
C1 C 0.5965(2) 0.16607(10) 0.35195(10) 0.0295(5) Uani 1 1 d . . . . .
C2 C 0.7745(2) 0.17998(10) 0.34313(9) 0.0254(4) Uani 1 1 d . . . . .
C3 C 0.8943(3) 0.13627(12) 0.37250(11) 0.0393(5) Uani 1 1 d . . . . .
H3 H 0.8691 0.0984 0.4020 0.047 Uiso 1 1 calc R U . . .
C4 C 1.0521(3) 0.14838(14) 0.35834(12) 0.0460(6) Uani 1 1 d . . . . .
H4 H 1.1369 0.1184 0.3773 0.055 Uiso 1 1 calc R U . . .
C5 C 1.0841(2) 0.20447(13) 0.31647(11) 0.0387(5) Uani 1 1 d . . . . .
H5 H 1.1916 0.2127 0.3054 0.046 Uiso 1 1 calc R U . . .
C6 C 0.9601(2) 0.24921(11) 0.29030(10) 0.0288(4) Uani 1 1 d . . . . .
C7 C 0.9898(3) 0.31295(13) 0.24721(13) 0.0426(6) Uani 1 1 d . . . . .
H7A H 0.9854 0.2978 0.2001 0.064 Uiso 1 1 calc R U . . .
H7B H 1.0966 0.3332 0.2607 0.064 Uiso 1 1 calc R U . . .
H7C H 0.9069 0.3497 0.2525 0.064 Uiso 1 1 calc R U . . .
C8 C 0.3631(2) 0.39475(10) 0.17965(9) 0.0222(4) Uani 1 1 d . . . . .
C9 C 0.3733(2) 0.42838(10) 0.24303(9) 0.0227(4) Uani 1 1 d . . . . .
C10 C 0.2672(2) 0.48419(11) 0.25464(10) 0.0288(4) Uani 1 1 d . . . . .
H10 H 0.2732 0.5067 0.2975 0.035 Uiso 1 1 calc R U . . .
C11 C 0.1536(2) 0.50755(11) 0.20502(10) 0.0330(5) Uani 1 1 d . . . . .
H11 H 0.0832 0.5464 0.2135 0.040 Uiso 1 1 calc R U . . .
C12 C 0.1427(2) 0.47401(12) 0.14273(11) 0.0337(5) Uani 1 1 d . . . . .
H12 H 0.0640 0.4896 0.1085 0.040 Uiso 1 1 calc R U . . .
C13 C 0.2459(2) 0.41802(11) 0.13026(10) 0.0290(4) Uani 1 1 d . . . . .
H13 H 0.2369 0.3951 0.0875 0.035 Uiso 1 1 calc R U . . .
C14 C 0.3679(2) 0.25875(10) 0.11304(10) 0.0250(4) Uani 1 1 d . . . . .
C15 C 0.2758(2) 0.21036(11) 0.14700(11) 0.0306(4) Uani 1 1 d . . . . .
H15 H 0.2888 0.2081 0.1947 0.037 Uiso 1 1 calc R U . . .
C16 C 0.1653(3) 0.16540(11) 0.11161(12) 0.0383(5) Uani 1 1 d . . . . .
H16 H 0.1005 0.1335 0.1352 0.046 Uiso 1 1 calc R U . . .
C17 C 0.1492(3) 0.16691(12) 0.04249(12) 0.0421(6) Uani 1 1 d . . . . .
H17 H 0.0737 0.1359 0.0184 0.051 Uiso 1 1 calc R U . . .
C18 C 0.2426(3) 0.21339(13) 0.00824(12) 0.0428(6) Uani 1 1 d . . . . .
H18 H 0.2327 0.2137 -0.0395 0.051 Uiso 1 1 calc R U . . .
C19 C 0.3511(3) 0.25974(12) 0.04306(11) 0.0356(5) Uani 1 1 d . . . . .
H19 H 0.4140 0.2922 0.0192 0.043 Uiso 1 1 calc R U . . .
C20 C 0.6344(2) 0.35617(11) 0.10542(10) 0.0263(4) Uani 1 1 d . . . . .
C21 C 0.7480(3) 0.31004(12) 0.08151(12) 0.0401(5) Uani 1 1 d . . . . .
H21 H 0.7543 0.2614 0.0967 0.048 Uiso 1 1 calc R U . . .
C22 C 0.8523(3) 0.33401(14) 0.03572(12) 0.0456(6) Uani 1 1 d . . . . .
H22 H 0.9286 0.3016 0.0194 0.055 Uiso 1 1 calc R U . . .
C23 C 0.8458(3) 0.40401(14) 0.01390(12) 0.0436(6) Uani 1 1 d . . . . .
H23 H 0.9169 0.4203 -0.0178 0.052 Uiso 1 1 calc R U . . .
C24 C 0.7363(3) 0.45063(14) 0.03793(14) 0.0545(7) Uani 1 1 d . . . . .
H24 H 0.7330 0.4995 0.0234 0.065 Uiso 1 1 calc R U . . .
C25 C 0.6300(3) 0.42702(12) 0.08332(12) 0.0425(6) Uani 1 1 d . . . . .
H25 H 0.5538 0.4597 0.0993 0.051 Uiso 1 1 calc R U . . .
C26 C 0.6711(2) 0.46583(10) 0.32257(9) 0.0230(4) Uani 1 1 d . . . . .
C27 C 0.6550(3) 0.53517(12) 0.29628(11) 0.0363(5) Uani 1 1 d . . . . .
H27 H 0.5590 0.5485 0.2699 0.044 Uiso 1 1 calc R U . . .
C28 C 0.7786(3) 0.58509(13) 0.30852(12) 0.0452(6) Uani 1 1 d . . . . .
H28 H 0.7663 0.6327 0.2910 0.054 Uiso 1 1 calc R U . . .
C29 C 0.9184(3) 0.56610(14) 0.34567(12) 0.0437(6) Uani 1 1 d . . . . .
H29 H 1.0030 0.6004 0.3536 0.052 Uiso 1 1 calc R U . . .
C30 C 0.9361(3) 0.49758(14) 0.37146(13) 0.0455(6) Uani 1 1 d . . . . .
H30 H 1.0330 0.4845 0.3973 0.055 Uiso 1 1 calc R U . . .
C31 C 0.8136(2) 0.44757(12) 0.35993(11) 0.0351(5) Uani 1 1 d . . . . .
H31 H 0.8271 0.4002 0.3778 0.042 Uiso 1 1 calc R U . . .
C32 C 0.4074(2) 0.39732(10) 0.38345(9) 0.0242(4) Uani 1 1 d . . . . .
C33 C 0.3928(2) 0.45826(11) 0.42325(9) 0.0271(4) Uani 1 1 d . . . . .
H33 H 0.4487 0.5014 0.4138 0.032 Uiso 1 1 calc R U . . .
C34 C 0.2965(3) 0.45615(12) 0.47687(10) 0.0355(5) Uani 1 1 d . . . . .
H34 H 0.2876 0.4976 0.5043 0.043 Uiso 1 1 calc R U . . .
C35 C 0.2136(3) 0.39365(14) 0.49031(11) 0.0414(5) Uani 1 1 d . . . . .
H35 H 0.1464 0.3925 0.5265 0.050 Uiso 1 1 calc R U . . .
C36 C 0.2286(3) 0.33318(13) 0.45116(11) 0.0414(5) Uani 1 1 d . . . . .
H36 H 0.1710 0.2904 0.4602 0.050 Uiso 1 1 calc R U . . .
C37 C 0.3272(2) 0.33442(11) 0.39869(10) 0.0326(5) Uani 1 1 d . . . . .
H37 H 0.3401 0.2920 0.3729 0.039 Uiso 1 1 calc R U . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 '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
N1 Cu1 O1 81.76(6) . . ?
N1 Cu1 P1 132.24(5) . . ?
O1 Cu1 P1 118.81(4) . . ?
N1 Cu1 P2 123.28(5) . . ?
O1 Cu1 P2 111.53(4) . . ?
P1 Cu1 P2 90.626(19) . . ?
C20 P1 C14 103.43(9) . . ?
C20 P1 C8 104.06(9) . . ?
C14 P1 C8 101.78(8) . . ?
C20 P1 Cu1 120.06(7) . . ?
C14 P1 Cu1 121.18(7) . . ?
C8 P1 Cu1 103.56(6) . . ?
C26 P2 C32 104.44(8) . . ?
C26 P2 C9 105.23(9) . . ?
C32 P2 C9 102.26(8) . . ?
C26 P2 Cu1 118.41(6) . . ?
C32 P2 Cu1 120.56(6) . . ?
C9 P2 Cu1 103.75(6) . . ?
C1 O1 Cu1 113.38(12) . . ?
C6 N1 C2 118.88(17) . . ?
C6 N1 Cu1 129.77(14) . . ?
C2 N1 Cu1 111.33(12) . . ?
O2 C1 O1 127.1(2) . . ?
O2 C1 C2 116.9(2) . . ?
O1 C1 C2 115.91(16) . . ?
N1 C2 C3 122.44(19) . . ?
N1 C2 C1 115.85(17) . . ?
C3 C2 C1 121.67(19) . . ?
C2 C3 C4 118.8(2) . . ?
C2 C3 H3 120.6 . . ?
C4 C3 H3 120.6 . . ?
C5 C4 C3 118.9(2) . . ?
C5 C4 H4 120.5 . . ?
C3 C4 H4 120.5 . . ?
C4 C5 C6 120.3(2) . . ?
C4 C5 H5 119.9 . . ?
C6 C5 H5 119.9 . . ?
N1 C6 C5 120.6(2) . . ?
N1 C6 C7 117.08(18) . . ?
C5 C6 C7 122.30(19) . . ?
C6 C7 H7A 109.5 . . ?
C6 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C6 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C13 C8 C9 119.03(17) . . ?
C13 C8 P1 121.68(14) . . ?
C9 C8 P1 119.26(14) . . ?
C10 C9 C8 119.22(17) . . ?
C10 C9 P2 122.11(15) . . ?
C8 C9 P2 118.61(14) . . ?
C11 C10 C9 121.22(18) . . ?
C11 C10 H10 119.4 . . ?
C9 C10 H10 119.4 . . ?
C10 C11 C12 119.53(19) . . ?
C10 C11 H11 120.2 . . ?
C12 C11 H11 120.2 . . ?
C13 C12 C11 120.24(19) . . ?
C13 C12 H12 119.9 . . ?
C11 C12 H12 119.9 . . ?
C12 C13 C8 120.74(19) . . ?
C12 C13 H13 119.6 . . ?
C8 C13 H13 119.6 . . ?
C15 C14 C19 119.05(19) . . ?
C15 C14 P1 116.67(15) . . ?
C19 C14 P1 124.26(15) . . ?
C16 C15 C14 120.4(2) . . ?
C16 C15 H15 119.8 . . ?
C14 C15 H15 119.8 . . ?
C17 C16 C15 120.2(2) . . ?
C17 C16 H16 119.9 . . ?
C15 C16 H16 119.9 . . ?
C16 C17 C18 120.0(2) . . ?
C16 C17 H17 120.0 . . ?
C18 C17 H17 120.0 . . ?
C17 C18 C19 120.4(2) . . ?
C17 C18 H18 119.8 . . ?
C19 C18 H18 119.8 . . ?
C18 C19 C14 120.0(2) . . ?
C18 C19 H19 120.0 . . ?
C14 C19 H19 120.0 . . ?
C25 C20 C21 118.31(19) . . ?
C25 C20 P1 124.00(15) . . ?
C21 C20 P1 117.69(16) . . ?
C22 C21 C20 120.8(2) . . ?
C22 C21 H21 119.6 . . ?
C20 C21 H21 119.6 . . ?
C23 C22 C21 120.3(2) . . ?
C23 C22 H22 119.9 . . ?
C21 C22 H22 119.9 . . ?
C22 C23 C24 119.6(2) . . ?
C22 C23 H23 120.2 . . ?
C24 C23 H23 120.2 . . ?
C23 C24 C25 120.6(2) . . ?
C23 C24 H24 119.7 . . ?
C25 C24 H24 119.7 . . ?
C20 C25 C24 120.4(2) . . ?
C20 C25 H25 119.8 . . ?
C24 C25 H25 119.8 . . ?
C31 C26 C27 118.63(19) . . ?
C31 C26 P2 116.36(15) . . ?
C27 C26 P2 124.95(15) . . ?
C28 C27 C26 120.1(2) . . ?
C28 C27 H27 119.9 . . ?
C26 C27 H27 119.9 . . ?
C29 C28 C27 120.4(2) . . ?
C29 C28 H28 119.8 . . ?
C27 C28 H28 119.8 . . ?
C28 C29 C30 120.0(2) . . ?
C28 C29 H29 120.0 . . ?
C30 C29 H29 120.0 . . ?
C29 C30 C31 120.2(2) . . ?
C29 C30 H30 119.9 . . ?
C31 C30 H30 119.9 . . ?
C30 C31 C26 120.7(2) . . ?
C30 C31 H31 119.7 . . ?
C26 C31 H31 119.7 . . ?
C37 C32 C33 119.21(18) . . ?
C37 C32 P2 116.24(15) . . ?
C33 C32 P2 124.51(15) . . ?
C34 C33 C32 120.07(19) . . ?
C34 C33 H33 120.0 . . ?
C32 C33 H33 120.0 . . ?
C35 C34 C33 120.1(2) . . ?
C35 C34 H34 120.0 . . ?
C33 C34 H34 120.0 . . ?
C36 C35 C34 119.9(2) . . ?
C36 C35 H35 120.0 . . ?
C34 C35 H35 120.0 . . ?
C35 C36 C37 120.3(2) . . ?
C35 C36 H36 119.9 . . ?
C37 C36 H36 119.9 . . ?
C36 C37 C32 120.4(2) . . ?
C36 C37 H37 119.8 . . ?
C32 C37 H37 119.8 . . ?
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
Cu1 N1 2.0348(15) . ?
Cu1 O1 2.0541(13) . ?
Cu1 P1 2.2329(6) . ?
Cu1 P2 2.2480(5) . ?
P1 C20 1.8256(19) . ?
P1 C14 1.8301(19) . ?
P1 C8 1.8409(18) . ?
P2 C26 1.8241(19) . ?
P2 C32 1.8288(19) . ?
P2 C9 1.8358(19) . ?
O1 C1 1.266(3) . ?
O2 C1 1.232(2) . ?
N1 C6 1.347(2) . ?
N1 C2 1.353(2) . ?
C1 C2 1.526(3) . ?
C2 C3 1.374(3) . ?
C3 C4 1.382(3) . ?
C3 H3 0.9500 . ?
C4 C5 1.373(4) . ?
C4 H4 0.9500 . ?
C5 C6 1.389(3) . ?
C5 H5 0.9500 . ?
C6 C7 1.493(3) . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 C13 1.394(3) . ?
C8 C9 1.407(3) . ?
C9 C10 1.390(3) . ?
C10 C11 1.379(3) . ?
C10 H10 0.9500 . ?
C11 C12 1.386(3) . ?
C11 H11 0.9500 . ?
C12 C13 1.381(3) . ?
C12 H12 0.9500 . ?
C13 H13 0.9500 . ?
C14 C15 1.391(3) . ?
C14 C19 1.393(3) . ?
C15 C16 1.387(3) . ?
C15 H15 0.9500 . ?
C16 C17 1.376(3) . ?
C16 H16 0.9500 . ?
C17 C18 1.379(3) . ?
C17 H17 0.9500 . ?
C18 C19 1.388(3) . ?
C18 H18 0.9500 . ?
C19 H19 0.9500 . ?
C20 C25 1.383(3) . ?
C20 C21 1.387(3) . ?
C21 C22 1.385(3) . ?
C21 H21 0.9500 . ?
C22 C23 1.366(3) . ?
C22 H22 0.9500 . ?
C23 C24 1.370(3) . ?
C23 H23 0.9500 . ?
C24 C25 1.389(3) . ?
C24 H24 0.9500 . ?
C25 H25 0.9500 . ?
C26 C31 1.387(3) . ?
C26 C27 1.389(3) . ?
C27 C28 1.388(3) . ?
C27 H27 0.9500 . ?
C28 C29 1.369(4) . ?
C28 H28 0.9500 . ?
C29 C30 1.372(4) . ?
C29 H29 0.9500 . ?
C30 C31 1.380(3) . ?
C30 H30 0.9500 . ?
C31 H31 0.9500 . ?
C32 C37 1.388(3) . ?
C32 C33 1.391(3) . ?
C33 C34 1.391(3) . ?
C33 H33 0.9500 . ?
C34 C35 1.384(3) . ?
C34 H34 0.9500 . ?
C35 C36 1.377(3) . ?
C35 H35 0.9500 . ?
C36 C37 1.384(3) . ?
C36 H36 0.9500 . ?
C37 H37 0.9500 . ?
