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#$Date: 2023-04-19 11:39:37 +0300 (Wed, 19 Apr 2023) $
#$Revision: 282726 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/70/8107084.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_8107084
loop_
_publ_author_name
'Almutairi, Maha S.'
'Ghabbour, Hazem A.'
'Haress, Nadia G.'
'Attia, Mohamed I.'
_publ_section_title
;
 Crystal structure of
 5-methoxy-N′-[(3Z)-1-benzyl-5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-indole-2-carbohydrazide-DMSO
 (1/1), C27H25FN4O4S
;
_journal_issue                   4
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              1025
_journal_page_last               1027
_journal_paper_doi               10.1515/ncrs-2016-0033
_journal_volume                  231
_journal_year                    2016
_chemical_formula_sum            'C27 H25 F N4 O4 S'
_chemical_formula_weight         520.57
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                100.728(2)
_cell_angle_beta                 100.807(2)
_cell_angle_gamma                114.612(2)
_cell_formula_units_Z            2
_cell_length_a                   10.1996(5)
_cell_length_b                   11.4836(6)
_cell_length_c                   12.1907(8)
_cell_measurement_reflns_used    9634
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      30.41
_cell_measurement_theta_min      2.25
_cell_volume                     1218.03(12)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'COMS area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus micro tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0980
_diffrn_reflns_av_sigmaI/netI    0.0850
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            48730
_diffrn_reflns_theta_full        30.56
_diffrn_reflns_theta_max         30.56
_diffrn_reflns_theta_min         2.25
_diffrn_standards_decay_%        .
_diffrn_standards_interval_count .
_diffrn_standards_interval_time  .
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.184
_exptl_absorpt_correction_T_max  0.961
_exptl_absorpt_correction_T_min  0.871
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS_Bruker_2014
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.419
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             544
_exptl_crystal_size_max          0.358
_exptl_crystal_size_mid          0.057
_exptl_crystal_size_min          0.042
_refine_diff_density_max         0.408
_refine_diff_density_min         -0.509
_refine_diff_density_rms         0.072
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.953
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     345
_refine_ls_number_reflns         7452
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.953
_refine_ls_R_factor_all          0.1026
_refine_ls_R_factor_gt           0.0542
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0620P)²+0.7418P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1138
_refine_ls_wR_factor_ref         0.1319
_reflns_number_gt                4990
_reflns_number_total             7452
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            suppl_ncrs-2016-0033_suppl.cif
_cod_data_source_block           md9
_cod_original_sg_symbol_H-M      'P-1   '
_cod_database_code               8107084
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
_atom_site_disorder_assembly
_atom_site_disorder_group
F1 F 1.40455(12) 0.84058(11) 0.69213(10) 0.0213(3) Uani 1 1 d . . .
O1 O -0.19077(15) 0.03240(14) 0.02158(12) 0.0215(3) Uani 1 1 d . . .
O2 O 0.65735(14) 0.65059(13) 0.30080(12) 0.0186(3) Uani 1 1 d . . .
O3 O 0.63232(13) 0.35052(12) 0.55623(11) 0.0144(3) Uani 1 1 d . . .
N1 N 0.35059(16) 0.49225(15) 0.18665(13) 0.0116(3) Uani 1 1 d . . .
N2 N 0.64712(17) 0.52240(15) 0.42466(13) 0.0125(3) Uani 1 1 d . . .
N3 N 0.79770(16) 0.59337(14) 0.47710(13) 0.0118(3) Uani 1 1 d . . .
N4 N 0.87390(16) 0.42105(15) 0.67376(13) 0.0122(3) Uani 1 1 d . . .
C1 C 0.20650(19) 0.38943(17) 0.13759(15) 0.0108(3) Uani 1 1 d . . .
C2 C 0.0871(2) 0.37835(18) 0.05135(16) 0.0138(4) Uani 1 1 d . . .
H2A H 0.0975 0.4499 0.0192 0.017 Uiso 1 1 calc R . .
C3 C -0.0463(2) 0.26068(18) 0.01428(16) 0.0152(4) Uani 1 1 d . . .
H3A H -0.1300 0.2514 -0.0431 0.018 Uiso 1 1 calc R . .
C4 C -0.0605(2) 0.15319(18) 0.06053(16) 0.0149(4) Uani 1 1 d . . .
C5 C 0.0556(2) 0.16447(18) 0.14776(16) 0.0145(4) Uani 1 1 d . . .
H5A H 0.0440 0.0924 0.1795 0.017 Uiso 1 1 calc R . .
C6 C 0.19169(19) 0.28499(17) 0.18864(15) 0.0119(3) Uani 1 1 d . . .
C7 C 0.33439(19) 0.33077(18) 0.27221(16) 0.0130(3) Uani 1 1 d . . .
H7A H 0.3604 0.2834 0.3211 0.016 Uiso 1 1 calc R . .
C8 C 0.42743(19) 0.45736(17) 0.26809(15) 0.0113(3) Uani 1 1 d . . .
C9 C 0.58584(19) 0.55301(17) 0.33080(15) 0.0127(3) Uani 1 1 d . . .
C10 C 0.85203(19) 0.54961(17) 0.55472(15) 0.0106(3) Uani 1 1 d . . .
C11 C 1.01003(19) 0.60735(17) 0.62067(15) 0.0112(3) Uani 1 1 d . . .
C12 C 1.1395(2) 0.71492(17) 0.61911(16) 0.0136(4) Uani 1 1 d . . .
H12A H 1.1355 0.7689 0.5696 0.016 Uiso 1 1 calc R . .
C13 C 1.2740(2) 0.73923(18) 0.69315(16) 0.0147(4) Uani 1 1 d . . .
C14 C 1.2841(2) 0.66515(19) 0.76845(16) 0.0167(4) Uani 1 1 d . . .
H14A H 1.3795 0.6887 0.8199 0.020 Uiso 1 1 calc R . .
C15 C 1.1551(2) 0.55615(18) 0.76914(16) 0.0149(4) Uani 1 1 d . . .
H15A H 1.1601 0.5035 0.8198 0.018 Uiso 1 1 calc R . .
C16 C 1.01947(19) 0.52761(17) 0.69341(15) 0.0119(3) Uani 1 1 d . . .
C17 C 0.76857(19) 0.42847(17) 0.59205(15) 0.0113(3) Uani 1 1 d . . .
C18 C 0.8362(2) 0.32139(18) 0.73717(16) 0.0146(4) Uani 1 1 d . . .
H18A H 0.7375 0.3028 0.7504 0.017 Uiso 1 1 calc R . .
H18B H 0.9130 0.3596 0.8147 0.017 Uiso 1 1 calc R . .
C19 C 0.8281(2) 0.19028(18) 0.67525(16) 0.0134(4) Uani 1 1 d . . .
C20 C 0.6885(2) 0.07723(19) 0.62053(17) 0.0177(4) Uani 1 1 d . . .
H20A H 0.5985 0.0837 0.6198 0.021 Uiso 1 1 calc R . .
C21 C 0.6795(2) -0.0447(2) 0.56705(18) 0.0220(4) Uani 1 1 d . . .
H21A H 0.5837 -0.1213 0.5306 0.026 Uiso 1 1 calc R . .
C22 C 0.8096(2) -0.0549(2) 0.56671(18) 0.0232(4) Uani 1 1 d . . .
H22A H 0.8035 -0.1384 0.5302 0.028 Uiso 1 1 calc R . .
C23 C 0.9491(2) 0.0571(2) 0.61987(19) 0.0238(4) Uani 1 1 d . . .
H23A H 1.0387 0.0503 0.6192 0.029 Uiso 1 1 calc R . .
C24 C 0.9590(2) 0.17925(19) 0.67404(17) 0.0189(4) Uani 1 1 d . . .
H24A H 1.0551 0.2555 0.7104 0.023 Uiso 1 1 calc R . .
C25 C -0.2891(2) 0.0012(2) -0.09161(18) 0.0221(4) Uani 1 1 d . . .
H25A H -0.3622 -0.0943 -0.1186 0.033 Uiso 1 1 calc R . .
H25B H -0.2298 0.0220 -0.1464 0.033 Uiso 1 1 calc R . .
H25C H -0.3430 0.0547 -0.0876 0.033 Uiso 1 1 calc R . .
S1 S 0.53908(5) 0.81144(5) 0.08539(4) 0.01607(12) Uani 1 1 d . . .
O4 O 0.39759(15) 0.70642(14) 0.09922(13) 0.0208(3) Uani 1 1 d . . .
C26 C 0.6464(2) 0.7289(2) 0.04849(18) 0.0213(4) Uani 1 1 d . . .
H26A H 0.5907 0.6607 -0.0278 0.032 Uiso 1 1 calc R . .
H26B H 0.6639 0.6859 0.1081 0.032 Uiso 1 1 calc R . .
H26C H 0.7436 0.7947 0.0449 0.032 Uiso 1 1 calc R . .
C27 C 0.6595(2) 0.9112(2) 0.22935(18) 0.0244(4) Uani 1 1 d . . .
H27A H 0.6135 0.9606 0.2672 0.037 Uiso 1 1 calc R . .
H27B H 0.7576 0.9749 0.2253 0.037 Uiso 1 1 calc R . .
H27C H 0.6737 0.8532 0.2748 0.037 Uiso 1 1 calc R . .
H1N2 H 0.598(3) 0.455(2) 0.444(2) 0.025(6) Uiso 1 1 d . . .
H1N1 H 0.388(3) 0.574(3) 0.168(2) 0.035(7) Uiso 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'
F F 0.0171 0.0103 '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'
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
C4 O1 C25 116.79(14) . .
C1 N1 C8 108.56(14) . .
C1 N1 H1N1 124.9(15) . .
C8 N1 H1N1 126.5(15) . .
N3 N2 C9 118.33(15) . .
N3 N2 H1N2 118.6(16) . .
C9 N2 H1N2 122.5(16) . .
C10 N3 N2 115.71(15) . .
C17 N4 C16 110.82(14) . .
C17 N4 C18 123.34(15) . .
C16 N4 C18 125.69(15) . .
N1 C1 C2 129.73(16) . .
N1 C1 C6 108.48(15) . .
C2 C1 C6 121.78(16) . .
C3 C2 C1 117.96(16) . .
C3 C2 H2A 121.0 . .
C1 C2 H2A 121.0 . .
C2 C3 C4 120.87(17) . .
C2 C3 H3A 119.6 . .
C4 C3 H3A 119.6 . .
C5 C4 O1 116.47(16) . .
C5 C4 C3 121.52(16) . .
O1 C4 C3 122.01(16) . .
C4 C5 C6 118.44(16) . .
C4 C5 H5A 120.8 . .
C6 C5 H5A 120.8 . .
C5 C6 C1 119.34(16) . .
C5 C6 C7 134.25(17) . .
C1 C6 C7 106.32(15) . .
C8 C7 C6 106.69(15) . .
C8 C7 H7A 126.7 . .
C6 C7 H7A 126.7 . .
N1 C8 C7 109.94(15) . .
N1 C8 C9 117.82(15) . .
C7 C8 C9 132.23(16) . .
O2 C9 N2 123.13(16) . .
O2 C9 C8 122.55(16) . .
N2 C9 C8 114.31(15) . .
N3 C10 C11 125.68(15) . .
N3 C10 C17 127.88(16) . .
C11 C10 C17 106.41(15) . .
C12 C11 C16 120.55(16) . .
C12 C11 C10 132.48(16) . .
C16 C11 C10 106.91(15) . .
C13 C12 C11 116.53(16) . .
C13 C12 H12A 121.7 . .
C11 C12 H12A 121.7 . .
F1 C13 C12 118.85(16) . .
F1 C13 C14 117.67(16) . .
C12 C13 C14 123.48(17) . .
C13 C14 C15 120.18(17) . .
C13 C14 H14A 119.9 . .
C15 C14 H14A 119.9 . .
C16 C15 C14 117.36(17) . .
C16 C15 H15A 121.3 . .
C14 C15 H15A 121.3 . .
C15 C16 C11 121.81(16) . .
C15 C16 N4 128.82(16) . .
C11 C16 N4 109.37(15) . .
O3 C17 N4 126.32(16) . .
O3 C17 C10 127.19(16) . .
N4 C17 C10 106.48(14) . .
N4 C18 C19 114.17(14) . .
N4 C18 H18A 108.7 . .
C19 C18 H18A 108.7 . .
N4 C18 H18B 108.7 . .
C19 C18 H18B 108.7 . .
H18A C18 H18B 107.6 . .
C20 C19 C24 118.82(18) . .
C20 C19 C18 120.08(16) . .
C24 C19 C18 121.09(17) . .
C21 C20 C19 120.68(18) . .
C21 C20 H20A 119.7 . .
C19 C20 H20A 119.7 . .
C22 C21 C20 120.13(18) . .
C22 C21 H21A 119.9 . .
C20 C21 H21A 119.9 . .
C21 C22 C23 119.73(19) . .
C21 C22 H22A 120.1 . .
C23 C22 H22A 120.1 . .
C22 C23 C24 120.46(19) . .
C22 C23 H23A 119.8 . .
C24 C23 H23A 119.8 . .
C23 C24 C19 120.18(18) . .
C23 C24 H24A 119.9 . .
C19 C24 H24A 119.9 . .
O1 C25 H25A 109.5 . .
O1 C25 H25B 109.5 . .
H25A C25 H25B 109.5 . .
O1 C25 H25C 109.5 . .
H25A C25 H25C 109.5 . .
H25B C25 H25C 109.5 . .
O4 S1 C27 106.39(9) . .
O4 S1 C26 106.36(9) . .
C27 S1 C26 97.58(10) . .
S1 C26 H26A 109.5 . .
S1 C26 H26B 109.5 . .
H26A C26 H26B 109.5 . .
S1 C26 H26C 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
S1 C27 H27A 109.5 . .
S1 C27 H27B 109.5 . .
H27A C27 H27B 109.5 . .
S1 C27 H27C 109.5 . .
H27A C27 H27C 109.5 . .
H27B C27 H27C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
F1 C13 1.360(2) .
O1 C4 1.378(2) .
O1 C25 1.427(2) .
O2 C9 1.222(2) .
O3 C17 1.230(2) .
N1 C1 1.369(2) .
N1 C8 1.370(2) .
N1 H1N1 0.95(3) .
N2 N3 1.352(2) .
N2 C9 1.374(2) .
N2 H1N2 0.83(2) .
N3 C10 1.291(2) .
N4 C17 1.364(2) .
N4 C16 1.415(2) .
N4 C18 1.459(2) .
C1 C2 1.395(2) .
C1 C6 1.418(2) .
C2 C3 1.375(3) .
C2 H2A 0.9500 .
C3 C4 1.415(2) .
C3 H3A 0.9500 .
C4 C5 1.378(3) .
C5 C6 1.405(2) .
C5 H5A 0.9500 .
C6 C7 1.428(2) .
C7 C8 1.383(2) .
C7 H7A 0.9500 .
C8 C9 1.465(2) .
C10 C11 1.452(2) .
C10 C17 1.504(2) .
C11 C12 1.389(2) .
C11 C16 1.406(2) .
C12 C13 1.377(3) .
C12 H12A 0.9500 .
C13 C14 1.380(3) .
C14 C15 1.391(3) .
C14 H14A 0.9500 .
C15 C16 1.380(3) .
C15 H15A 0.9500 .
C18 C19 1.514(3) .
C18 H18A 0.9900 .
C18 H18B 0.9900 .
C19 C20 1.393(3) .
C19 C24 1.395(3) .
C20 C21 1.387(3) .
C20 H20A 0.9500 .
C21 C22 1.380(3) .
C21 H21A 0.9500 .
C22 C23 1.385(3) .
C22 H22A 0.9500 .
C23 C24 1.388(3) .
C23 H23A 0.9500 .
C24 H24A 0.9500 .
C25 H25A 0.9800 .
C25 H25B 0.9800 .
C25 H25C 0.9800 .
S1 O4 1.5109(13) .
S1 C27 1.781(2) .
S1 C26 1.7865(19) .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
C27 H27A 0.9800 .
C27 H27B 0.9800 .
C27 H27C 0.9800 .
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
C9 N2 N3 C10 -171.47(15) . . . .
C8 N1 C1 C2 179.95(17) . . . .
C8 N1 C1 C6 -0.67(19) . . . .
N1 C1 C2 C3 177.70(17) . . . .
C6 C1 C2 C3 -1.6(3) . . . .
C1 C2 C3 C4 -1.4(3) . . . .
C25 O1 C4 C5 -158.86(17) . . . .
C25 O1 C4 C3 21.6(3) . . . .
C2 C3 C4 C5 3.1(3) . . . .
C2 C3 C4 O1 -177.37(17) . . . .
O1 C4 C5 C6 178.82(16) . . . .
C3 C4 C5 C6 -1.6(3) . . . .
C4 C5 C6 C1 -1.4(3) . . . .
C4 C5 C6 C7 -177.31(19) . . . .
N1 C1 C6 C5 -176.41(16) . . . .
C2 C1 C6 C5 3.0(3) . . . .
N1 C1 C6 C7 0.57(19) . . . .
C2 C1 C6 C7 -179.99(16) . . . .
C5 C6 C7 C8 176.07(19) . . . .
C1 C6 C7 C8 -0.26(19) . . . .
C1 N1 C8 C7 0.51(19) . . . .
C1 N1 C8 C9 179.24(15) . . . .
C6 C7 C8 N1 -0.15(19) . . . .
C6 C7 C8 C9 -178.63(18) . . . .
N3 N2 C9 O2 -8.6(3) . . . .
N3 N2 C9 C8 170.48(14) . . . .
N1 C8 C9 O2 -11.9(3) . . . .
C7 C8 C9 O2 166.45(18) . . . .
N1 C8 C9 N2 168.96(14) . . . .
C7 C8 C9 N2 -12.7(3) . . . .
N2 N3 C10 C11 178.73(16) . . . .
N2 N3 C10 C17 1.1(3) . . . .
N3 C10 C11 C12 -1.6(3) . . . .
C17 C10 C11 C12 176.45(18) . . . .
N3 C10 C11 C16 -178.95(16) . . . .
C17 C10 C11 C16 -0.90(18) . . . .
C16 C11 C12 C13 -1.1(2) . . . .
C10 C11 C12 C13 -178.18(18) . . . .
C11 C12 C13 F1 177.82(15) . . . .
C11 C12 C13 C14 -1.6(3) . . . .
F1 C13 C14 C15 -176.85(16) . . . .
C12 C13 C14 C15 2.6(3) . . . .
C13 C14 C15 C16 -0.7(3) . . . .
C14 C15 C16 C11 -2.0(3) . . . .
C14 C15 C16 N4 177.59(17) . . . .
C12 C11 C16 C15 3.0(3) . . . .
C10 C11 C16 C15 -179.29(16) . . . .
C12 C11 C16 N4 -176.68(15) . . . .
C10 C11 C16 N4 1.05(19) . . . .
C17 N4 C16 C15 179.57(18) . . . .
C18 N4 C16 C15 4.0(3) . . . .
C17 N4 C16 C11 -0.81(19) . . . .
C18 N4 C16 C11 -176.42(15) . . . .
C16 N4 C17 O3 179.99(16) . . . .
C18 N4 C17 O3 -4.3(3) . . . .
C16 N4 C17 C10 0.21(19) . . . .
C18 N4 C17 C10 175.95(15) . . . .
N3 C10 C17 O3 -1.3(3) . . . .
C11 C10 C17 O3 -179.34(17) . . . .
N3 C10 C17 N4 178.43(16) . . . .
C11 C10 C17 N4 0.44(18) . . . .
C17 N4 C18 C19 87.4(2) . . . .
C16 N4 C18 C19 -97.5(2) . . . .
N4 C18 C19 C20 -105.05(19) . . . .
N4 C18 C19 C24 76.4(2) . . . .
C24 C19 C20 C21 0.8(3) . . . .
C18 C19 C20 C21 -177.71(17) . . . .
C19 C20 C21 C22 -0.6(3) . . . .
C20 C21 C22 C23 -0.1(3) . . . .
C21 C22 C23 C24 0.4(3) . . . .
C22 C23 C24 C19 -0.1(3) . . . .
C20 C19 C24 C23 -0.5(3) . . . .
C18 C19 C24 C23 178.01(17) . . . .
