Photochemical Behavior of Azobenzene-Conjugated CoII, CoIII, and FeII Bis(terpyridine) Complexes
Tomona Yutaka; Ichiro Mori; Masato Kurihara; Naoto Tamai; Hiroshi Nishihara; Inorganic Chemistry 42 (2003) 6306–6313; doi:10.1021/ic0260466

data_4314297
_publ_section_title
;
 Photochemical Behavior of Azobenzene-Conjugated CoII, CoIII, and FeII
 Bis(terpyridine) Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6306
_journal_page_last               6313
_journal_paper_doi               10.1021/ic0260466
_journal_volume                  42
_journal_year                    2003
_chemical_formula_moiety         'C106 H84 B2 Co N12 '
_chemical_formula_sum            'C106 H84 B2 Co N12'
_chemical_formula_weight         1606.46
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.8040(7)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   22.895(5)
_cell_length_b                   21.1422(11)
_cell_length_c                   18.7864(5)
_cell_measurement_reflns_used    11928
_cell_measurement_temperature    293.1
_cell_measurement_theta_max      12.7
_cell_measurement_theta_min      1.5
_cell_volume                     8705(2)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure Ver. 2.00'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SIR97
_diffrn_detector_area_resol_mean 7.32
_diffrn_measured_fraction_theta_full 0.9796
_diffrn_measured_fraction_theta_max 0.9796
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.033
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -27
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            32977
_diffrn_reflns_theta_full        25.20
_diffrn_reflns_theta_max         25.20
_exptl_absorpt_coefficient_mu    0.254
_exptl_absorpt_correction_T_max  0.000
_exptl_absorpt_correction_T_min  0.000
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.226
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.85
_refine_diff_density_min         -0.58
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   3.543
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     570
_refine_ls_number_reflns         4644
_refine_ls_R_factor_gt           0.0970
_refine_ls_shift/su_max          0.0070
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/\s^2^(Fo)'
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_ref         0.1160
_reflns_number_gt                4644
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_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            ic0260466si20030806_054220.cif
_cod_data_source_block           '__4'
_cod_original_cell_volume        8705.1(14)
_cod_original_formula_sum        'C106 H84 B2 Co N12 '
_cod_database_code               4314297