Visible-Light-Induced, Copper-Catalyzed Three-Component Coupling of Alkyl Halides, Olefins, and Trifluoromethylthiolate to Generate Trifluoromethyl Thioethers.
He, Jian; Chen, Caiyou; Fu, Gregory C.; Peters, Jonas C.; ACS catalysis 8 (2018) 11741–11748; doi:10.1021/acscatal.8b04094

data_4515798
_publ_section_title
;
 Visible-Light-Induced, Copper-Catalyzed Three-Component Coupling of Alkyl
 Halides, Olefins, and Trifluoromethylthiolate to Generate Trifluoromethyl
 Thioethers.
;
_journal_issue                   12
_journal_name_full               'ACS catalysis'
_journal_page_first              11741
_journal_page_last               11748
_journal_paper_doi               10.1021/acscatal.8b04094
_journal_volume                  8
_journal_year                    2018
_chemical_formula_moiety         'C90 H64 Cu2 F6 P4 S2'
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_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
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;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
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_diffrn_measurement_method       '\f and \w scans'
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_diffrn_radiation_wavelength     0.71073
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_diffrn_reflns_Laue_measured_fraction_full 0.999
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'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.0662 before and 0.0526 after correction. The Ratio of minimum to maximum transmission is 0.9459. The \l/2 correction factor is Not present.'
_exptl_crystal_colour            'clear yellow'
_exptl_crystal_colour_lustre     clear
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0551P)^2^+0.8397P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_total             25546
_reflns_threshold_expression     'I > 2\s(I)'
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_shelx_estimated_absorpt_t_min   0.851
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C43(H43), C12(H12), C9(H9), C16(H16), C11(H11), C35(H35), C23(H23), C28(H28),
 C44(H44), C45(H45), C6(H6), C39(H39), C22(H22), C42(H42), C21(H21), C15(H15),
 C13(H13), C29(H29), C4(H4), C33(H33), C10(H10), C19(H19), C38(H38), C5(H5),
 C25(H25), C7(H7), C3(H3), C18(H18), C24(H24), C32(H32), C17(H17), C34(H34)
;
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_olex2_submission_special_instructions 'No special instructions were received'