Palladium-Catalyzed Asymmetric Arylation, Vinylation, and Allenylation of tert-Cyclobutanols via Enantioselective C-C Bond Cleavage
Satoshi Matsumura; Yasunari Maeda; Takahiro Nishimura; Sakae Uemura; Journal of the American Chemical Society 125 (2003) 8862–8869; doi:10.1021/ja035293l

data_4113951
_publ_section_title
;
 Palladium-Catalyzed Asymmetric Arylation, Vinylation, and Allenylation of
 tert-Cyclobutanols via Enantioselective C-C Bond Cleavage
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              8862
_journal_page_last               8869
_journal_paper_doi               10.1021/ja035293l
_journal_volume                  125
_journal_year                    2003
_chemical_formula_moiety         'C23 H19 Cl O2 '
_chemical_formula_sum            'C23 H19 Cl O2'
_chemical_formula_weight         362.85
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.257(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
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_cell_length_b                   6.0079(3)
_cell_length_c                   19.615(1)
_cell_measurement_reflns_used    10169
_cell_measurement_temperature    296.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      2.2
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_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure Ver. 2.00'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SIR97
_diffrn_detector_area_resol_mean 10.00
_diffrn_measured_fraction_theta_full 0.9969
_diffrn_measured_fraction_theta_max 0.9950
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.039
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            15073
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    0.222
_exptl_absorpt_correction_T_max  0.978
_exptl_absorpt_correction_T_min  0.715
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
    Higashi, T. (1995). Program for Absorption Correction.
    Rigaku Corporation, Tokyo, Japan.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.311
_exptl_crystal_description       block
_exptl_crystal_size_max          0.60
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.10
_refine_diff_density_max         2.27
_refine_diff_density_min         -3.99
_refine_ls_extinction_coef       76.0(6)
_refine_ls_extinction_method
'Larson (1970) Crystallographic Computing eq. 22'
_refine_ls_goodness_of_fit_ref   1.074
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     312
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_refine_ls_R_factor_gt           0.0360
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_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1.0'
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_reflns_threshold_expression     F^2^>2.0\s(F^2^)
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_cod_data_source_block           '_matsumura001_____________'
_cod_original_cell_volume        1837.8(2)
_cod_original_formula_sum        'C23 H19 Cl O2 '
_cod_database_code               4113951