Synthesis of Tungsten (1-Pyridinio)imido Complexes: Facile N-N Bond Cleavage To Form Pyridine from Coordinated Dinitrogen1
Youichi Ishii; Shin'ichi Tokunaga; Hidetake Seino; Masanobu Hidai; Inorganic Chemistry 35 (1996) 5118–5119; doi:10.1021/ic960632f

data_4323892
_publ_section_title
;
 Synthesis of Tungsten (1-Pyridinio)imido Complexes: Facile N-N Bond
 Cleavage To Form Pyridine from Coordinated Dinitrogen1
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5118
_journal_page_last               5119
_journal_paper_doi               10.1021/ic960632f
_journal_volume                  35
_journal_year                    1996
_chemical_formula_sum            'C26 H33 Cl2 F3 N2 O4 P2 S W'
_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 Jun 18 12:03:08 1996'
_audit_creation_method           'from TEXRAY.INF file'
_cell_angle_alpha                90
_cell_angle_beta                 93.58(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4.00
_cell_length_a                   8.823(4)
_cell_length_b                   34.939(5)
_cell_length_c                   10.729(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    20.0
_cell_measurement_theta_max      26.73
_cell_measurement_theta_min      23.77
_cell_volume                     3300.9(18)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        'teXsan: PROCESS (MSC)'
_computing_publication_material  'teXsan: FINISH (MSC)'
_computing_structure_refinement  'teXsan: LS (MSC)'
_computing_structure_solution    'DIRDIF92 (PATTY)'
_diffrn_ambient_temperature      20.0
_diffrn_measurement_device       AFC7R
_diffrn_measurement_method       'omega/2-theta scans'
_diffrn_orient_matrix_UB_11      -0.06939
_diffrn_orient_matrix_UB_12      0.00716
_diffrn_orient_matrix_UB_13      -0.07355
_diffrn_orient_matrix_UB_21      0.07017
_diffrn_orient_matrix_UB_22      -0.01265
_diffrn_orient_matrix_UB_23      -0.05700
_diffrn_orient_matrix_UB_31      -0.05618
_diffrn_orient_matrix_UB_32      -0.02465
_diffrn_orient_matrix_UB_33      0.00787
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           MoKalpha
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  3.94
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_diffrn_reflns_limit_h_min       0
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_diffrn_reflns_theta_min         2.5850
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_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu_cm 38.754
_exptl_absorpt_correction_T_max  0.998
_exptl_absorpt_correction_T_min  0.949
_exptl_absorpt_correction_type   psi-scan
_exptl_crystal_colour            blue
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_refine_ls_matrix_type           full
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_refine_ls_number_reflns         3753
_refine_ls_number_restraints     0
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_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
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_cod_data_source_file            ic960632f.cif
_cod_data_source_block           '[WCl2(NNC5H2Me3)(PMe2Ph)(CO)][OTf]'
_cod_original_cell_volume        3301(1)
_cod_original_sg_symbol_H-M      'P 21/n '
_cod_original_formula_sum        'C26 H33 W P2 O4 F3 S Cl2 N2'
_cod_database_code               4323892