A general approach to stereospecific Pd-catalyzed cross-coupling reactions of benzylic stereocenters.
Binayeva, Meruyert; Ma, Xinghua; Ghaemimohammadi, Pejman; Biscoe, Mark R.; Chemical science 14 (2023) 14124–14130; doi:10.1039/d3sc04519f

data_1570370
_publ_section_title
;
 A general approach to stereospecific Pd-catalyzed cross-coupling
 reactions of benzylic stereocenters.
;
_journal_issue                   48
_journal_name_full               'Chemical science'
_journal_page_first              14124
_journal_page_last               14130
_journal_paper_doi               10.1039/d3sc04519f
_journal_volume                  14
_journal_year                    2023
_chemical_absolute_configuration ad
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_chemical_formula_sum            'C32 H53 B O2 Sn'
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_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
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_audit_update_record
;
2023-08-26 deposited with the CCDC.	2023-11-16 downloaded from the CCDC.
;
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_diffrn_measurement_device_type  'Bruker D8 with PHOTON III detector'
_diffrn_measurement_method       '\f and \w shutterless scans'
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; 
 Classical Flack method preferred over Parsons because s.u. lower. 
;
_refine_ls_abs_structure_Flack   0.023(9)
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.1090P)^2^+3.2258P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                12256
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_cod_data_source_file            d3sc04519f2.cif
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_cod_depositor_comments          'Adding full bibliography for 1570370.cif.'
_cod_original_sg_symbol_H-M      'P 21'
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_shelx_estimated_absorpt_t_min   0.269
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