Reductive N−N Bond Cleavage of Diphenylhydrazine and Azobenzene Induced by Coordinatively Unsaturated Cp*Fe{N(SiMe3)2}
Ohki, Yasuhiro; Takikawa, Yuko; Hatanaka, Tsubasa; Tatsumi, Kazuyuki; Organometallics 25 (2006) 3111–; doi:10.1021/om0602963

data_4075457
_publ_section_title
;
 Reductive N&#x2212;N Bond Cleavage of Diphenylhydrazine and Azobenzene
 Induced by Coordinatively Unsaturated Cp*Fe{N(SiMe3)2}
;
_journal_issue                   13
_journal_name_full               Organometallics
_journal_page_first              3111
_journal_paper_doi               10.1021/om0602963
_journal_volume                  25
_journal_year                    2006
_chemical_formula_moiety         'C34 H46 Fe2 N2 '
_chemical_formula_sum            'C34 H46 Fe2 N2'
_chemical_formula_weight         594.44
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                91.378(10)
_cell_angle_beta                 90.12(6)
_cell_angle_gamma                99.34(4)
_cell_formula_units_Z            2
_cell_length_a                   10.349(8)
_cell_length_b                   12.101(4)
_cell_length_c                   12.420(3)
_cell_measurement_reflns_used    103
_cell_measurement_temperature    113.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.2
_cell_volume                     1534.3(14)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.7.0'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SHELXS97
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.959
_diffrn_measured_fraction_theta_max 0.959
_diffrn_measurement_device_type  'Rigaku Saturn'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.029
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            12570
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    0.969
_exptl_absorpt_correction_T_max  0.824
_exptl_absorpt_correction_T_min  0.714
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.287
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             632.00
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.05
_refine_diff_density_max         2.07
_refine_diff_density_min         -0.69
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.470
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     364
_refine_ls_number_reflns         6568
_refine_ls_R_factor_gt           0.0826
_refine_ls_shift/su_max          0.0000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details
'w = 1/[0.0010Fo^2^ + 3.0000\s(Fo^2^) + 0.5000]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1097
_reflns_number_gt                5290
_reflns_number_total             6745
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            om0602963si20060404_084627.cif
_cod_data_source_block           '__Cp2Fe2(NPhMe)2'
_cod_original_formula_sum        'C34 H46 Fe2 N2 '
_cod_database_code               4075457