Redox-neutral photochemical Heck-type arylation of vinylphenols activated by visible light
Liang, Kangjiang; Li, Tao; Li, Na; Zhang, Yang; Shen, Lei; Ma, Zhixian; Xia, Chengfeng; Chemical Science 11 (2020) 2130–2135; doi:10.1039/C9SC06184C

data_1556992
_publ_section_title
;
 Redox-neutral photochemical Heck-type arylation of vinylphenols activated
 by visible light
;
_journal_issue                   8
_journal_name_full               'Chemical Science'
_journal_page_first              2130
_journal_page_last               2135
_journal_paper_doi               10.1039/C9SC06184C
_journal_volume                  11
_journal_year                    2020
_chemical_formula_moiety         'C18 H16 O4'
_chemical_formula_sum            'C18 H16 O4'
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_space_group_IT_number           60
_space_group_name_Hall           '-P 2n 2ab'
_space_group_name_H-M_alt        'P b c n'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2019-05-21 deposited with the CCDC.	2020-01-10 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_cell_angle_gamma                90
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_cell_measurement_reflns_used    9970
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_cell_measurement_theta_min      2.66
_cell_volume                     2883.2(4)
_computing_cell_refinement       'Bruker SAINT'
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_computing_structure_refinement  'SHELXL-2014 (Sheldrick 2014)'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.940
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_diffrn_reflns_limit_h_max       13
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_diffrn_reflns_limit_l_min       -35
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_exptl_crystal_description       block
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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^)+(0.0593P)^2^+1.2533P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1080
_refine_ls_wR_factor_ref         0.1148
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3759
_reflns_number_total             4416
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c9sc06184c2.cif
_cod_data_source_block           mo_xlb301_0m
_cod_depositor_comments
;Adding full bibliography for 1556992.cif.

 Adding full bibliography for 1556992.cif.
;
_cod_database_code               1556992
_shelx_shelxl_version_number     2014/7
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