<i>N</i>,<i>N</i>',<i>N</i>''-Trimethyl-<i>N</i>,<i>N</i>',<i>N</i>''-tris(3-methylphenyl)-1,3,5-benzenetricarboxamide is cubic (space group <i>Pa</i>øverline{3}) and not orthorhombic (space group <i>Pbca</i>). Erratum
Herbstein, Frank H.; Acta Crystallographica Section C 55 (1999) 1196–; doi:10.1107/S0108270198013924

data_2008723
_publ_section_title
;<i>N</i>,<i>N</i>',<i>N</i>''-Trimethyl-<i>N</i>,<i>N</i>',<i>N</i>''-tris(3-methylphenyl)-1,3,5-benzenetricarboxamide
 is cubic (space group <i>Pa</i>\/overline{3}) and not orthorhombic (space
 group <i>Pbca</i>). Erratum
;
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1196
_journal_paper_doi               10.1107/S0108270198013924
_journal_volume                  55
_journal_year                    1999
_chemical_formula_sum            'C33 H33 N3 O3'
_chemical_formula_weight         519.644
_chemical_melting_point          185.3
_chemical_name_systematic
;
N,N',N''-Trimethyl-N,N',N''-tris(3-methylphenyl)-1,3,5-
benzenetricarboxamide
;
_space_group_IT_number           205
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.862(1)
_cell_length_b                   17.862(1)
_cell_length_c                   17.862(1)
_cell_measurement_temperature    295
_cell_volume                     5698.9(6)
_computing_structure_refinement  'RCRYSTAN (Rigaku Corporation, 1985)'
_computing_structure_solution    'SAPI85 version of MULTAN'
_diffrn_ambient_temperature      293(2)
_diffrn_measurement_device       'Rigaku AFC5'
_diffrn_measurement_method       \w/2\q
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54050
_exptl_absorpt_coefficient_mu    0.63
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.2113
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prisms
_exptl_crystal_F_000             2208
_refine_ls_extinction_method     none
_refine_ls_hydrogen_treatment    refall
_refine_ls_matrix_type           full
_refine_ls_number_parameters     310
_refine_ls_number_reflns         1204
_refine_ls_number_restraints     0
_refine_ls_R_factor_obs          0.067
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo)+(0.02Fo^2^)]'
_refine_ls_weighting_scheme      calc
_cod_data_source_file            sk1189.cif
_cod_data_source_block           sk1189
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc w =
1/[\s^2^(Fo)+(0.02Fo^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^(Fo)+(0.02Fo^2^)]'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        5698.9(17)
_cod_original_sg_symbol_H-M      'P  a  -3'
_cod_database_code               2008723