Catalytic Cascade Dehydrogenative Cross-Coupling of BH/CH and BH/NH: One-Pot Process to Carborano-Isoquinolinone.
Au, Yik Ki; Lyu, Hairong; Quan, Yangjian; Xie, Zuowei; Journal of the American Chemical Society 141 (2019) 12855–12862; doi:10.1021/jacs.9b06204

data_4127705
_publ_section_title
;
 Catalytic Cascade Dehydrogenative Cross-Coupling of BH/CH and BH/NH:
 One-Pot Process to Carborano-Isoquinolinone.
;
_journal_issue                   32
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              12855
_journal_page_last               12862
_journal_paper_doi               10.1021/jacs.9b06204
_journal_volume                  141
_journal_year                    2019
_chemical_formula_sum            'C12 H21 B10 N O2'
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_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
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_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'BRUKER D8VENTURE DIFFRACTOMETER'
_diffrn_measurement_method       'PHI & OMEGA SCAN'
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_exptl_absorpt_coefficient_mu    0.069
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_refine_ls_extinction_coef       0.016(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
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_refine_ls_restrained_S_all      1.105
_refine_ls_R_factor_all          0.0721
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_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0599P)^2^+1.1408P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
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_shelx_estimated_absorpt_t_min   0.973
_shelx_estimated_absorpt_t_max   0.986
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