Anticancer and Antifertility Agents. II. <i>N</i>,<i>N</i>'-Hexamethylenebis(3-pyridinecarboxamide)
Liu, Q.; Zhang, S.-W.; Wei, Y. G.; Shao, M.-C.; Acta Crystallographica Section C 52 (1996) 2260–2261; doi:10.1107/S0108270196005045

data_2005433
_publ_section_title
;
 Anticancer and Antifertility Agents. II.
 <i>N</i>,<i>N</i>'-Hexamethylenebis(3-pyridinecarboxamide)
;
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              2260
_journal_page_last               2261
_journal_paper_doi               10.1107/S0108270196005045
_journal_volume                  52
_journal_year                    1996
_chemical_formula_moiety         'C18 H22 N4 O2'
_chemical_formula_sum            'C18 H22 N4 O2'
_chemical_formula_weight         326.4
_chemical_name_systematic
;
N,N'-hexamethylenebis(3-pyridinecarboxamide)
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
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_cell_angle_beta                 94.53(3)
_cell_angle_gamma                90
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_cell_length_a                   5.2240(10)
_cell_length_b                   5.0960(10)
_cell_length_c                   31.006(6)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296.0(1)
_cell_measurement_theta_max      10
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_cell_volume                     822.8(3)
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_computing_data_collection       'Rigaku PC/AFS software'
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'\y scans (Coppens, Leiserowitz & Rabinovich, 1965)'
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_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'w = 1/[\s^2^(F) + 0.0010F^2^]'
was changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to 'w = 1/[\s^2^(F) +
0.0010F^2^]'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2005433