#------------------------------------------------------------------------------
#$Date: 2025-08-22 17:55:42 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301864 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/21/17/7211713.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_7211713
loop_
_publ_author_name
'Hazra, Susanta'
'Sasmal, Sujit'
'Nayak, Malabika'
'Sparkes, Hazel A.'
'Howard, Judith A. K.'
'Mohanta, Sasankasekhar'
_publ_section_title
;
 Syntheses and crystal structures of CuIIBiIII, CuIIBaIICuII, [CuIIPbII]2
 and cocrystallized (UVIO2)2.4CuII complexes: structural diversity of the
 coordination compounds derived from
 N,N′-ethylenebis(3-ethoxysalicylaldiimine)
;
_journal_issue                   2
_journal_name_full               CrystEngComm
_journal_page_first              470
_journal_paper_doi               10.1039/b913408e
_journal_volume                  12
_journal_year                    2010
_chemical_formula_moiety         'C40 H44 Cu2 N8 O20 Pb2'
_chemical_formula_sum            'C40 H44 Cu2 N8 O20 Pb2'
_chemical_formula_weight         1498.29
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 106.438(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   14.368(2)
_cell_length_b                   13.590(2)
_cell_length_c                   12.525(2)
_cell_measurement_reflns_used    5102
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      29.940
_cell_measurement_theta_min      2.426
_cell_volume                     2345.7(6)
_computing_cell_refinement       'SMART (Bruker, 1998)'
_computing_data_collection       'SMART (Bruker, 1998)'
_computing_data_reduction        'SAINT (Bruker, 1998)'
_computing_molecular_graphics    'ORTEP3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      120(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker Proteum M'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Bede Microsource'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0297
_diffrn_reflns_av_sigmaI/netI    0.0261
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            17279
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         3.55
_exptl_absorpt_coefficient_mu    8.138
_exptl_absorpt_correction_T_max  0.272
_exptl_absorpt_correction_T_min  0.164
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS, (G. Sheldrick, 1998)'
_exptl_crystal_colour            dark_red
_exptl_crystal_density_diffrn    2.121
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1444
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.16
_refine_diff_density_max         1.854
_refine_diff_density_min         -0.671
_refine_diff_density_rms         0.113
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.067
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     337
_refine_ls_number_reflns         4114
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.071
_refine_ls_R_factor_all          0.0253
_refine_ls_R_factor_gt           0.0230
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0268P)²+4.6821P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0548
_refine_ls_wR_factor_ref         0.0558
_reflns_number_gt                3860
_reflns_number_total             4114
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b913408e.txt
_cod_data_source_block           3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_cell_volume        2345.8(7)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7211713
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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
Pb1 Pb 0.306155(10) 0.514014(10) 0.886752(12) 0.01741(6) Uani 1 1 d . . .
Cu1 Cu 0.15858(3) 0.65057(3) 1.00356(4) 0.01721(11) Uani 1 1 d . . .
O1A O 0.2781(7) 0.3442(7) 0.9906(5) 0.0222(15) Uani 0.66 1 d P A 1
O1B O 0.3007(15) 0.3534(16) 1.0264(12) 0.0222(15) Uani 0.34 1 d P A 2
O2 O 0.2054(2) 0.51830(19) 1.0128(2) 0.0205(6) Uani 1 1 d . A .
O3 O 0.21968(19) 0.67119(19) 0.8886(2) 0.0193(6) Uani 1 1 d . A .
O4 O 0.3341(2) 0.6694(2) 0.7568(2) 0.0225(6) Uani 1 1 d . A .
O5 O 0.4164(2) 0.6434(2) 1.0175(2) 0.0282(7) Uani 1 1 d . A .
O6 O 0.4558(3) 0.4992(2) 1.0881(3) 0.0344(8) Uani 1 1 d . A .
O7 O 0.5506(2) 0.6241(2) 1.1482(3) 0.0302(7) Uani 1 1 d . A .
O8 O 0.1299(2) 0.4658(3) 0.7844(3) 0.0384(8) Uani 1 1 d U A .
O9 O 0.2045(3) 0.4656(2) 0.6582(3) 0.0352(8) Uani 1 1 d . A .
O10 O 0.0493(3) 0.4412(3) 0.6139(3) 0.0508(10) Uani 1 1 d . A .
N1 N 0.0759(3) 0.6276(3) 1.0964(3) 0.0238(8) Uani 1 1 d . A .
N2 N 0.1309(2) 0.7875(2) 1.0184(3) 0.0202(7) Uani 1 1 d . A .
N3 N 0.4748(2) 0.5889(3) 1.0850(3) 0.0242(8) Uani 1 1 d . . .
N4 N 0.1269(3) 0.4576(3) 0.6835(3) 0.0275(8) Uani 1 1 d . . .
C1A C 0.4076(6) 0.2231(7) 1.0645(8) 0.0484(19) Uani 0.66 1 d P A 1
H1A H 0.4579 0.2722 1.0661 0.073 Uiso 0.66 1 calc PR A 1
H1B H 0.4304 0.1580 1.0493 0.073 Uiso 0.66 1 calc PR A 1
H1C H 0.3937 0.2221 1.1367 0.073 Uiso 0.66 1 calc PR A 1
C1B C 0.3447(12) 0.1898(13) 0.9803(15) 0.0484(19) Uani 0.34 1 d P A 2
H1D H 0.3171 0.2120 0.9033 0.073 Uiso 0.34 1 calc PR A 2
H1E H 0.2955 0.1531 1.0043 0.073 Uiso 0.34 1 calc PR A 2
H1F H 0.4006 0.1472 0.9846 0.073 Uiso 0.34 1 calc PR A 2
C2A C 0.3163(5) 0.2493(5) 0.9741(6) 0.0280(13) Uani 0.66 1 d P A 1
H2A H 0.3306 0.2487 0.9013 0.034 Uiso 0.66 1 calc PR A 1
H2B H 0.2663 0.1985 0.9719 0.034 Uiso 0.66 1 calc PR A 1
C2B C 0.3759(10) 0.2758(10) 1.0532(12) 0.0280(13) Uani 0.34 1 d P A 2
H2C H 0.4373 0.3020 1.0435 0.034 Uiso 0.34 1 calc PR A 2
H2D H 0.3880 0.2556 1.1319 0.034 Uiso 0.34 1 calc PR A 2
C3 C 0.2248(3) 0.3526(3) 1.0696(4) 0.0272(10) Uani 1 1 d . . .
C4 C 0.2083(4) 0.2756(3) 1.1337(4) 0.0364(12) Uani 1 1 d . A .
H4 H 0.2412 0.2149 1.1348 0.044 Uiso 1 1 calc R . .
C5 C 0.1438(4) 0.2869(3) 1.1963(4) 0.0404(12) Uani 1 1 d . . .
H5 H 0.1314 0.2335 1.2392 0.048 Uiso 1 1 calc R A .
C6 C 0.0979(4) 0.3748(3) 1.1967(4) 0.0363(11) Uani 1 1 d . A .
H6 H 0.0532 0.3817 1.2394 0.044 Uiso 1 1 calc R . .
C7 C 0.1158(3) 0.4558(3) 1.1346(4) 0.0252(9) Uani 1 1 d . . .
C8 C 0.1817(3) 0.4456(3) 1.0714(3) 0.0197(8) Uani 1 1 d . A .
C9 C 0.0659(3) 0.5465(3) 1.1439(4) 0.0266(9) Uani 1 1 d . A .
H9 H 0.0225 0.5458 1.1887 0.032 Uiso 1 1 calc R . .
C10 C 0.0184(3) 0.7146(3) 1.1073(4) 0.0306(10) Uani 1 1 d . . .
H10A H 0.0035 0.7131 1.1798 0.037 Uiso 1 1 calc R A .
H10B H -0.0436 0.7150 1.0473 0.037 Uiso 1 1 calc R . .
C11 C 0.0767(3) 0.8059(3) 1.0997(3) 0.0238(9) Uani 1 1 d . A .
H11A H 0.0328 0.8629 1.0758 0.029 Uiso 1 1 calc R . .
H11B H 0.1222 0.8211 1.1733 0.029 Uiso 1 1 calc R . .
C12 C 0.1613(3) 0.8593(3) 0.9704(3) 0.0205(8) Uani 1 1 d . . .
H12 H 0.1421 0.9239 0.9842 0.025 Uiso 1 1 calc R A .
C13 C 0.2220(3) 0.8493(3) 0.8974(3) 0.0208(9) Uani 1 1 d . A .
C14 C 0.2573(3) 0.9376(3) 0.8645(4) 0.0259(9) Uani 1 1 d . . .
H14 H 0.2376 0.9987 0.8879 0.031 Uiso 1 1 calc R A .
C15 C 0.3191(3) 0.9370(3) 0.7995(4) 0.0304(10) Uani 1 1 d . A .
H15 H 0.3438 0.9971 0.7800 0.037 Uiso 1 1 calc R . .
C16 C 0.3458(3) 0.8478(3) 0.7621(4) 0.0285(10) Uani 1 1 d . . .
H16 H 0.3881 0.8474 0.7159 0.034 Uiso 1 1 calc R A .
C17 C 0.3114(3) 0.7602(3) 0.7914(3) 0.0221(9) Uani 1 1 d . A .
C18 C 0.2497(3) 0.7585(3) 0.8611(3) 0.0184(8) Uani 1 1 d . . .
C19 C 0.3933(3) 0.6696(3) 0.6804(4) 0.0268(10) Uani 1 1 d . . .
H19A H 0.4568 0.7006 0.7162 0.032 Uiso 1 1 calc R A .
H19B H 0.3608 0.7080 0.6131 0.032 Uiso 1 1 calc R . .
C20 C 0.4082(3) 0.5654(3) 0.6487(4) 0.0299(10) Uani 1 1 d . A .
H20A H 0.4428 0.5285 0.7153 0.045 Uiso 1 1 calc R . .
H20B H 0.4464 0.5652 0.5951 0.045 Uiso 1 1 calc R . .
H20C H 0.3451 0.5346 0.6149 0.045 Uiso 1 1 calc R . .
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'
Pb Pb -3.3944 10.1111 '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_3
O2 Pb1 O3 65.14(9) .
O2 Pb1 O8 69.29(10) .
O3 Pb1 O8 78.38(10) .
O2 Pb1 O5 86.74(10) .
O3 Pb1 O5 68.27(9) .
O8 Pb1 O5 144.98(10) .
O2 Pb1 O1A 61.0(2) .
O3 Pb1 O1A 125.6(2) .
O8 Pb1 O1A 76.46(17) .
O5 Pb1 O1A 114.52(12) .
O2 Pb1 O4 125.30(8) .
O3 Pb1 O4 60.21(8) .
O8 Pb1 O4 100.80(10) .
O5 Pb1 O4 72.03(9) .
O1A Pb1 O4 172.06(15) .
O2 Pb1 O1B 59.1(5) .
O3 Pb1 O1B 124.2(5) .
O8 Pb1 O1B 85.2(4) .
O5 Pb1 O1B 104.5(3) .
O1A Pb1 O1B 10.0(3) .
O4 Pb1 O1B 173.5(4) .
O2 Pb1 O6 82.18(10) .
O3 Pb1 O6 108.11(9) .
O8 Pb1 O6 145.01(11) .
O5 Pb1 O6 46.64(9) .
O1A Pb1 O6 72.07(14) .
O4 Pb1 O6 112.34(9) .
O1B Pb1 O6 62.4(3) .
O2 Pb1 O9 114.93(10) .
O3 Pb1 O9 95.22(9) .
O8 Pb1 O9 45.70(10) .
O5 Pb1 O9 145.05(9) .
O1A Pb1 O9 100.21(12) .
O4 Pb1 O9 73.04(9) .
O1B Pb1 O9 110.1(3) .
O6 Pb1 O9 155.65(10) .
O2 Pb1 O7 133.76(9) 3_667
O3 Pb1 O7 159.53(9) 3_667
O8 Pb1 O7 113.51(10) 3_667
O5 Pb1 O7 101.51(9) 3_667
O1A Pb1 O7 74.5(2) 3_667
O4 Pb1 O7 100.19(9) 3_667
O1B Pb1 O7 74.9(5) 3_667
O6 Pb1 O7 72.30(9) 3_667
O9 Pb1 O7 83.40(9) 3_667
O3 Cu1 N1 169.36(14) .
O3 Cu1 O2 87.42(12) .
N1 Cu1 O2 94.46(14) .
O3 Cu1 N2 94.74(13) .
N1 Cu1 N2 85.31(14) .
O2 Cu1 N2 169.48(14) .
C3 O1A C2A 118.4(7) .
C3 O1A Pb1 116.5(5) .
C2A O1A Pb1 125.1(6) .
C3 O1B C2B 121.7(16) .
C3 O1B Pb1 115.1(12) .
C2B O1B Pb1 123.2(13) .
C8 O2 Cu1 126.3(3) .
C8 O2 Pb1 129.3(2) .
Cu1 O2 Pb1 104.32(11) .
C18 O3 Cu1 125.0(2) .
C18 O3 Pb1 124.3(2) .
Cu1 O3 Pb1 102.70(11) .
C17 O4 C19 116.2(3) .
C17 O4 Pb1 114.3(2) .
C19 O4 Pb1 126.9(2) .
N3 O5 Pb1 101.4(2) .
N3 O6 Pb1 91.2(2) .
N4 O8 Pb1 105.7(3) .
N4 O9 Pb1 90.3(2) .
C9 N1 C10 120.6(4) .
C9 N1 Cu1 126.6(3) .
C10 N1 Cu1 112.8(3) .
C12 N2 C11 120.8(3) .
C12 N2 Cu1 125.7(3) .
C11 N2 Cu1 113.4(3) .
O7 N3 O5 120.1(4) .
O7 N3 O6 120.8(4) .
O5 N3 O6 119.1(4) .
O10 N4 O9 122.3(4) .
O10 N4 O8 119.7(4) .
O9 N4 O8 118.0(4) .
C2B C1B H1D 109.5 .
C2B C1B H1E 109.5 .
H1D C1B H1E 109.5 .
C2B C1B H1F 109.5 .
H1D C1B H1F 109.5 .
H1E C1B H1F 109.5 .
O1A C2A C1A 112.9(6) .
O1A C2A H2A 109.0 .
C1A C2A H2A 109.0 .
O1A C2A H2B 109.0 .
C1A C2A H2B 109.0 .
H2A C2A H2B 107.8 .
C1B C2B O1B 110.5(13) .
C1B C2B H2C 109.6 .
O1B C2B H2C 109.6 .
C1B C2B H2D 109.6 .
O1B C2B H2D 109.6 .
H2C C2B H2D 108.1 .
O1B C3 C4 122.2(10) .
O1B C3 C8 114.0(10) .
C4 C3 C8 121.4(4) .
C4 C3 O1A 124.2(5) .
C8 C3 O1A 114.2(5) .
C3 C4 C5 120.0(4) .
C3 C4 H4 120.0 .
C5 C4 H4 120.0 .
C6 C5 C4 120.1(4) .
C6 C5 H5 120.0 .
C4 C5 H5 120.0 .
C5 C6 C7 121.1(4) .
C5 C6 H6 119.5 .
C7 C6 H6 119.5 .
C8 C7 C6 119.4(4) .
C8 C7 C9 123.9(4) .
C6 C7 C9 116.6(4) .
O2 C8 C7 123.8(4) .
O2 C8 C3 118.3(4) .
C7 C8 C3 117.8(4) .
N1 C9 C7 124.9(4) .
N1 C9 H9 117.5 .
C7 C9 H9 117.5 .
N1 C10 C11 108.5(3) .
N1 C10 H10A 110.0 .
C11 C10 H10A 110.0 .
N1 C10 H10B 110.0 .
C11 C10 H10B 110.0 .
H10A C10 H10B 108.4 .
N2 C11 C10 108.4(3) .
N2 C11 H11A 110.0 .
C10 C11 H11A 110.0 .
N2 C11 H11B 110.0 .
C10 C11 H11B 110.0 .
H11A C11 H11B 108.4 .
N2 C12 C13 124.9(4) .
N2 C12 H12 117.5 .
C13 C12 H12 117.5 .
C14 C13 C18 119.5(4) .
C14 C13 C12 116.0(4) .
C18 C13 C12 124.4(4) .
C15 C14 C13 121.3(4) .
C15 C14 H14 119.4 .
C13 C14 H14 119.4 .
C14 C15 C16 119.6(4) .
C14 C15 H15 120.2 .
C16 C15 H15 120.2 .
C17 C16 C15 120.5(4) .
C17 C16 H16 119.7 .
C15 C16 H16 119.7 .
O4 C17 C16 123.7(4) .
O4 C17 C18 115.2(3) .
C16 C17 C18 121.0(4) .
O3 C18 C17 118.6(3) .
O3 C18 C13 123.5(4) .
C17 C18 C13 118.0(4) .
O4 C19 C20 109.1(3) .
O4 C19 H19A 109.9 .
C20 C19 H19A 109.9 .
O4 C19 H19B 109.9 .
C20 C19 H19B 109.9 .
H19A C19 H19B 108.3 .
C19 C20 H20A 109.5 .
C19 C20 H20B 109.5 .
H20A C20 H20B 109.5 .
C19 C20 H20C 109.5 .
H20A C20 H20C 109.5 .
H20B C20 H20C 109.5 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pb1 O2 2.427(3) .
Pb1 O3 2.474(3) .
Pb1 O8 2.579(3) .
Pb1 O5 2.611(3) .
Pb1 O1A 2.735(10) .
Pb1 O4 2.764(3) .
Pb1 O1B 2.81(2) .
Pb1 O6 2.820(4) .
Pb1 O9 2.897(4) .
Pb1 O7 2.909(3) 3_667
Cu1 O3 1.908(3) .
Cu1 N1 1.908(3) .
Cu1 O2 1.911(3) .
Cu1 N2 1.923(3) .
O1A C3 1.417(11) .
O1A C2A 1.439(12) .
O1B C3 1.35(2) .
O1B C2B 1.48(3) .
O2 C8 1.330(5) .
O3 C18 1.340(5) .
O4 C17 1.378(5) .
O4 C19 1.449(5) .
O5 N3 1.251(4) .
O6 N3 1.252(5) .
O7 N3 1.246(5) .
O8 N4 1.258(5) .
O9 N4 1.247(5) .
O10 N4 1.226(5) .
N1 C9 1.280(6) .
N1 C10 1.471(5) .
N2 C12 1.286(5) .
N2 C11 1.468(5) .
C1A C2A 1.513(11) .
C1A H1A 0.9800 .
C1A H1B 0.9800 .
C1A H1C 0.9800 .
C1B C2B 1.47(2) .
C1B H1D 0.9800 .
C1B H1E 0.9800 .
C1B H1F 0.9800 .
C2A H2A 0.9900 .
C2A H2B 0.9900 .
C2B H2C 0.9900 .
C2B H2D 0.9900 .
C3 C4 1.379(6) .
C3 C8 1.411(6) .
C4 C5 1.382(7) .
C4 H4 0.9500 .
C5 C6 1.365(7) .
C5 H5 0.9500 .
C6 C7 1.412(6) .
C6 H6 0.9500 .
C7 C8 1.402(6) .
C7 C9 1.448(6) .
C9 H9 0.9500 .
C10 C11 1.515(6) .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C11 H11A 0.9900 .
C11 H11B 0.9900 .
C12 C13 1.438(6) .
C12 H12 0.9500 .
C13 C14 1.409(6) .
C13 C18 1.410(6) .
C14 C15 1.363(6) .
C14 H14 0.9500 .
C15 C16 1.392(7) .
C15 H15 0.9500 .
C16 C17 1.378(6) .
C16 H16 0.9500 .
C17 C18 1.410(6) .
C19 C20 1.502(6) .
C19 H19A 0.9900 .
C19 H19B 0.9900 .
C20 H20A 0.9800 .
C20 H20B 0.9800 .
C20 H20C 0.9800 .
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139197392
