Ligand-controlled product selectivity in gold-catalyzed double cycloisomerization of 1,11-dien-3,9-diyne benzoates.
Rao, Weidong; Susanti, Dewi; Ayers, Benjamin James; Chan, Philip Wai Hong; Journal of the American Chemical Society 137 (2015) 6350–6355; doi:10.1021/jacs.5b02377

data_4123654
_publ_section_title
;
 Ligand-controlled product selectivity in gold-catalyzed double
 cycloisomerization of 1,11-dien-3,9-diyne benzoates.
;
_journal_issue                   19
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              6350
_journal_page_last               6355
_journal_paper_doi               10.1021/jacs.5b02377
_journal_volume                  137
_journal_year                    2015
_chemical_formula_sum            'C36 H55 N O3 S'
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_space_group_name_Hall           '-P 2ybc'
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_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
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_diffrn_ambient_temperature      103.(2)
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_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_theta_full        30.65
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_exptl_crystal_colour            'light yellow'
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_exptl_crystal_description       block
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_refine_ls_number_reflns         10032
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_refine_ls_R_factor_all          0.0677
_refine_ls_R_factor_gt           0.0514
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0650P)^2^+1.4101P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_cod_depositor_comments          'Adding full bibliography for 4123654.cif.'
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