Laser Photolysis Studies of the Reaction of Chromium(III) Octaethylporphyrin Complex with Triphenylphosphine and Triphenylphosphine Oxide
Masahiko Inamo; Nao Matsubara; Kiyohiko Nakajima; Tsutomu S. Iwayama; Hiroshi Okimi; Mikio Hoshino; Inorganic Chemistry 44 (2005) 6445–6455; doi:10.1021/ic0504487

data_4309494
_publ_contact_author_address
;
Department of Chemistry, Aichi University of Education, 
Kariya, Aichi 448-8542, Japan 
;
_publ_contact_author_email       ' minamo@auecc.aichi-edu.ac.jp '
_publ_contact_author_fax         ' +81-566-26-2636 '
_publ_contact_author_name        ' Masahiko Inamo '
_publ_contact_author_phone       ' +81-566-26-2636 '
_publ_section_title
;
Laser Photolysis Studies of the Reaction of Chromium(III)
Octaethylporphyrin Complex with Triphenylphosphine and Triphenylphosphine
Oxide
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6445
_journal_page_last               6455
_journal_paper_doi               10.1021/ic0504487
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'C66.5 H51 Cl2 Cr N4 O2 P'
_chemical_formula_weight         1092.04
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_audit_creation_date             'Tue Apr 27 17:38:30 2004'
_audit_creation_method           'by teXsan'
_audit_update_record
;
01/28/2005 text and data added by Kiyohiko Nakajima
;
_cell_angle_alpha                90
_cell_angle_beta                 89.699(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   24.8385(4)
_cell_length_b                   17.9520(4)
_cell_length_c                   13.3714(2)
_cell_measurement_reflns_used    42273
_cell_measurement_temperature    298.2
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      1.6
_cell_volume                     5962.24(19)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        'teXsan Ver. 1.10'
_computing_publication_material  'teXsan Ver. 1.10'
_computing_structure_refinement  'teXsan Ver. 1.10'
_computing_structure_solution    SIR92
_diffrn_measured_fraction_theta_full 0.9496
_diffrn_measured_fraction_theta_max 0.9496
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID Imaging Plate'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.018
_diffrn_reflns_limit_h_max       32
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            23096
_diffrn_reflns_theta_full        27.49
_diffrn_reflns_theta_max         27.49
_exptl_absorpt_coefficient_mu    0.355
_exptl_absorpt_correction_T_max  0.964
_exptl_absorpt_correction_T_min  0.908
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details   '(Higashi, 1999)'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.216
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.240
_exptl_crystal_size_min          0.180
_refine_diff_density_max         0.70
_refine_diff_density_min         -0.32
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   2.841
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     685
_refine_ls_number_reflns         7522
_refine_ls_R_factor_gt           0.0838
_refine_ls_shift/su_max          1.3366
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo) + 0.00063|Fo|^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1174
_reflns_number_gt                7522
_reflns_number_total             12999
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            ic0504487si20050325_122750.cif
_cod_data_source_block           crtppp
_cod_original_cell_volume        5962.2(2)
_cod_original_formula_sum        'C66.50 H51 Cl2 Cr N4 O2 P '
_cod_database_code               4309494