Substituted Butenylindium Generated by Transmetalation of Cyclopropylmethylstannane with Indium Iodide: Synthesis and Characterization of Monobutenylindium
Kiyokawa, Kensuke; Yasuda, Makoto; Baba, Akio; Organometallics 30 (2011) 2039–; doi:10.1021/om200094m

data_4064423
_publ_section_title
;
 Substituted Butenylindium Generated by Transmetalation of
 Cyclopropylmethylstannane with Indium Iodide: Synthesis and
 Characterization of Monobutenylindium
;
_journal_issue                   7
_journal_name_full               Organometallics
_journal_page_first              2039
_journal_paper_doi               10.1021/om200094m
_journal_volume                  30
_journal_year                    2011
_chemical_formula_moiety         'C25 H26 I2 In P'
_chemical_formula_sum            'C25 H26 I2 In P'
_chemical_formula_weight         726.08
_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'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                112.688(2)
_cell_angle_beta                 96.721(3)
_cell_angle_gamma                104.982(3)
_cell_formula_units_Z            2
_cell_length_a                   9.5951(8)
_cell_length_b                   11.9060(10)
_cell_length_c                   13.2587(9)
_cell_measurement_reflns_used    12177
_cell_measurement_temperature    123
_cell_measurement_theta_max      30.50
_cell_measurement_theta_min      3.12
_cell_volume                     1309.43(18)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    'CrystalStructure 4.0'
_computing_publication_material  'CrystalStructure 4.0 (Rigaku, 2010)'
_computing_structure_refinement  'CRYSTALS (Carruthers, et al., 1999)'
_computing_structure_solution    'DIRDIF99-PATTY (Gould, et al., 1999)'
_diffrn_ambient_temperature      123
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.977
_diffrn_measured_fraction_theta_max 0.977
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0760
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            16281
_diffrn_reflns_theta_full        30.50
_diffrn_reflns_theta_max         30.50
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    3.330
_exptl_absorpt_correction_T_max  0.189
_exptl_absorpt_correction_T_min  0.108
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.841
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             692.00
_exptl_crystal_size_max          0.700
_exptl_crystal_size_mid          0.600
_exptl_crystal_size_min          0.500
_refine_diff_density_max         2.370
_refine_diff_density_min         -1.250
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.011
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     288
_refine_ls_number_reflns         5299
_refine_ls_R_factor_gt           0.0463
_refine_ls_shift/su_max          0.000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[0.0002Fo^2^ + 1.0000\s(Fo^2^)]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0532
_reflns_number_gt                4223
_reflns_number_total             7774
_reflns_threshold_expression     F>2.0\s(F)
_cod_data_source_file            om200094m_si_002.cif
_cod_data_source_block           1021-2
_cod_original_cell_volume        1309.44(18)
_cod_database_code               4064423