Synthesis of Cationic Diiron Complexes Bridged by a Base-Stabilized Gallium Atom [Fp2(μ-Ga·Do2)]+X-(Fp = (η-C5H5)Fe(CO)2, Do2= 2,2‘-Bipyridine,N,N,N‘,N‘-Tetramethylethylenediamine, 1,10-Phenanthroline, (4-(Dimethylamino)pyridine)2, X-= [Fp2GaCl2]-, BPh4-)
Ueno, Keiji; Watanabe, Takahito; Ogino, Hiroshi; Organometallics 19 (2000) 5679–; doi:10.1021/om000673q

data_4077633
_publ_section_title
;
 Synthesis of Cationic Diiron Complexes Bridged by a Base-Stabilized
 Gallium Atom [Fp2(\m-Ga&#x00B7;Do2)]+X-(Fp = (\h-C5H5)Fe(CO)2, Do2=
 2,2&#x2018;-Bipyridine,N,N,N&#x2018;,N&#x2018;-Tetramethylethylenediamine,
 1,10-Phenanthroline, (4-(Dimethylamino)pyridine)2, X-= [Fp2GaCl2]-,
 BPh4-)
;
_journal_issue                   26
_journal_name_full               Organometallics
_journal_page_first              5679
_journal_paper_doi               10.1021/om000673q
_journal_volume                  19
_journal_year                    2000
_chemical_formula_moiety
'(C24 H18 Fe2 Ga O4 N2) (C14 H10 Fe2 Ga Cl2 O4) (C2 H3 N)'
_chemical_formula_sum            'C40 H31 Cl2 Fe4 Ga2 N3 O8'
_chemical_formula_weight         1115.42
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                93.54(3)
_cell_angle_beta                 99.38(4)
_cell_angle_gamma                78.16(3)
_cell_formula_units_Z            2
_cell_length_a                   13.816(6)
_cell_length_b                   14.931(4)
_cell_length_c                   10.731(5)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      14.81
_cell_measurement_theta_min      13.29
_cell_volume                     2136.7(15)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        TeXsan
_computing_molecular_graphics    ORTEP
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Rigaku AFC6S'
_diffrn_measurement_method       \w-2\q
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0362
_diffrn_reflns_av_sigmaI/netI    0.0950
_diffrn_reflns_limit_h_max       0
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            10199
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.52
_diffrn_standards_decay_%        -4.099
_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    2.744
_exptl_absorpt_correction_T_max  0.9998
_exptl_absorpt_correction_T_min  0.5406
_exptl_absorpt_correction_type   psi-scan
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.734
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             1112
_exptl_crystal_size_max          0.400
_exptl_crystal_size_mid          0.350
_exptl_crystal_size_min          0.150
_refine_diff_density_max         0.687
_refine_diff_density_min         -0.661
_refine_diff_density_rms         0.102
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.011
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     533
_refine_ls_number_reflns         9796
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.011
_refine_ls_R_factor_all          0.1330
_refine_ls_R_factor_gt           0.0506
_refine_ls_shift/su_max          0.101
_refine_ls_shift/su_mean         0.005
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0544P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1098
_refine_ls_wR_factor_ref         0.1349
_reflns_number_gt                5299
_reflns_number_total             9796
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om000673q.cif
_cod_data_source_block           '[Fp2Ga.bpy][Fp2GaCl2].AN'
_cod_database_code               4077633