Crystal structure of bis[(tetracarbonyl)(μ-arsenodiphenyl)manganese(I)], Mn2(CO)8(AsPh3)2
Ernst Horn; Hokura Horikawa; Akio Urushiyama; Keiko Miyamoto; Zeitschrift für Kristallographie - New Crystal Structures 226 (2011) 37–; doi:

data_8103066
_publ_section_title
;
 Crystal structure of bis[(tetracarbonyl)(\m-arsenodiphenyl)manganese(I)],
 Mn2(CO)8(AsPh3)2
;
_journal_issue                   1
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              37
_journal_volume                  226
_journal_year                    2011
_chemical_formula_moiety         'C32 H20 As2 Mn2 O8 '
_chemical_formula_sum            'C32 H20 As2 Mn2 O8'
_chemical_formula_weight         792.22
_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'
_cell_angle_alpha                90
_cell_angle_beta                 101.995(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.1457(8)
_cell_length_b                   16.549(1)
_cell_length_c                   15.910(1)
_cell_measurement_reflns_used    6025
_cell_measurement_temperature    273.2
_cell_measurement_theta_max      55.459
_cell_measurement_theta_min      4.575
_cell_volume                     3128.1(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT, SADABS'
_computing_molecular_graphics    ORTEP-II
_computing_publication_material  teXsan
_computing_structure_refinement  'texsan; SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'teXan; SHELXS-97 (Sheldrick, 1990)'
_diffrn_detector_area_resol_mean 8.366
_diffrn_measured_fraction_theta_full 0.9991
_diffrn_measured_fraction_theta_max 0.9991
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.021
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            18526
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_exptl_absorpt_coefficient_mu    2.957
_exptl_absorpt_correction_type   'empirical (SADABS)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.682
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_size_max          0.100
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.200
_refine_diff_density_max         0.29
_refine_diff_density_min         -0.29
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.129
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     397
_refine_ls_number_reflns         4135
_refine_ls_R_factor_gt           0.0269
_refine_ls_shift/su_max          0.0054
_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      unit
_refine_ls_wR_factor_ref         0.0284
_reflns_number_gt                4135
_reflns_number_total             5510
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            1267-3166.cff
_cod_data_source_block           A_TEXRAY.INF_file_is_not_p
_cod_original_sg_symbol_H-M      P21/n
_cod_original_formula_sum        'C32 H20 As2 Mn2 O8 '
_cod_database_code               8103066