Radical Mechanism in the Elimination of 2-Arylsulfinyl Esters
Antonio Latorre; Irakusne López; Victoria Ramírez; Santiago Rodríguez; Javier Izquierdo; Florenci V. González; Cristian Vicent; Journal of Organic Chemistry 77 (2012) 5191–5197; doi:10.1021/jo300699w

data_4027237
_publ_section_title
;
 Radical Mechanism in the Elimination of 2-Arylsulfinyl Esters
;
_journal_name_full               'Journal of Organic Chemistry'
_journal_page_first              5191
_journal_page_last               5197
_journal_paper_doi               10.1021/jo300699w
_journal_volume                  77
_journal_year                    2012
_chemical_absolute_configuration syn
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_chemical_name_systematic
; 
 ? 
;
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_cell_measurement_theta_max      26.65
_cell_measurement_theta_min      3.17
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_computing_cell_refinement       'Bruker SMART'
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_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.969
_diffrn_measured_fraction_theta_max 0.969
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
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_diffrn_radiation_type           MoK\a
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_diffrn_reflns_limit_l_min       -8
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_exptl_absorpt_correction_T_max  0.9783
_exptl_absorpt_correction_T_min  0.8413
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'Bruker SADABS'
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_exptl_crystal_F_000             284
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_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
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_refine_ls_R_factor_all          0.0685
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0536P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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