Enantioselective Pd-catalyzed hydrogenation of enesulfonamides
Chang-Bin Yu; Kao Gao; Duo-Sheng Wang; Lei Shi; Yong-Gui Zhou; Chem.Commun. 47 (2011) 5052–; doi:10.1039/c1cc10313j

data_7106294
_publ_section_title
;
 Enantioselective Pd-catalyzed hydrogenation of enesulfonamides
;
_journal_name_full               Chem.Commun.
_journal_page_first              5052
_journal_paper_doi               10.1039/c1cc10313j
_journal_volume                  47
_journal_year                    2011
_chemical_formula_sum            'C15 H15 N O2 S'
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_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   4.972(4)
_cell_length_b                   13.870(10)
_cell_length_c                   19.934(14)
_cell_measurement_reflns_used    1227
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      20.21
_cell_measurement_theta_min      2.94
_cell_volume                     1374.7(18)
_computing_cell_refinement       'Bruker SAINT'
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_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
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_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_sigmaI/netI    0.0931
_diffrn_reflns_limit_h_max       6
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_diffrn_reflns_limit_l_min       -20
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_diffrn_reflns_theta_max         25.99
_diffrn_reflns_theta_min         2.52
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_exptl_absorpt_correction_T_max  0.9660
_exptl_absorpt_correction_T_min  0.9528
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
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_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       stick
_exptl_crystal_F_000             576
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_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   -0.07(14)
_refine_ls_extinction_method     none
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_refine_ls_number_reflns         2682
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_refine_ls_restrained_S_all      1.015
_refine_ls_R_factor_all          0.0907
_refine_ls_R_factor_gt           0.0588
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0405P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_cod_original_sg_symbol_H-M      P2(1)2(1)2(1)
_cod_database_code               7106294