A flexible interpenetrating coordination framework with a bimodal porous functionality
Tapas Kumar Maj; Ryotaro Matsuda; Susumu Kitagawa; Nature Materials 6 (2007) 142–148; doi:10.1038/nmat1827

data_1552084
_publ_section_title
;
 A flexible interpenetrating coordination framework with a bimodal porous
 functionality
;
_journal_name_full               'Nature Materials'
_journal_page_first              142
_journal_page_last               148
_journal_paper_doi               10.1038/nmat1827
_journal_volume                  6
_journal_year                    2007
_chemical_formula_sum            'C14 H12 N5 Ni0.5 O2.5'
_chemical_formula_weight         319.63
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_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.39(5)
_cell_angle_gamma                90
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_cell_length_b                   19.99(3)
_cell_length_c                   8.632(13)
_cell_measurement_reflns_used    130
_cell_measurement_temperature    223.2
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.1
_cell_volume                     3091(8)
_computing_cell_refinement       CRYSTALCLEAR
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_computing_data_reduction        'teXsan Ver. 1.11'
_computing_publication_material  'teXsan Ver. 1.11'
_computing_structure_refinement  'teXsan Ver. 1.10'
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_diffrn_measured_fraction_theta_max 0.9721
_diffrn_measurement_device_type  'Rigaku/MSC Mercury CCD'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
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_diffrn_reflns_av_R_equivalents  0.044
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -23
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_exptl_crystal_colour            violet
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_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
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_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo) + 0.00063|Fo|^2^]'
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_cod_original_formula_sum        'C14 H12 N5 O2.50 Ni0.50 '
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