Sulfurative self-condensation of ketones and elemental sulfur: a three-component access to thiophenes catalyzed by aniline acid‒base conjugate pairs
Nguyen, Thanh Binh; Retailleau, Pascal; Green Chemistry 20 (2018) 387–; doi:10.1039/C7GC03437G

data_7229731
_publ_section_title
;
 Sulfurative self-condensation of ketones and elemental sulfur: a
 three-component access to thiophenes catalyzed by aniline acid--base
 conjugate pairs
;
_journal_issue                   2
_journal_name_full               'Green Chemistry'
_journal_page_first              387
_journal_paper_doi               10.1039/C7GC03437G
_journal_volume                  20
_journal_year                    2018
_chemical_formula_moiety         'C20 H20 O2 S'
_chemical_formula_sum            'C20 H20 O2 S'
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;
2017-08-28 deposited with the CCDC.
2017-12-13 downloaded from the CCDC.
;
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;
CrystalClear-SM Expert 2.0 r16 (Rigaku, 2014)
;
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;
CrystalClear-SM Expert 2.0 r16 (Rigaku, 2014)
;
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;
CrystalClear-SM Expert 2.0 r16 (Rigaku, 2014)
;
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2015)'
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;
Crystal Goniometer Chi-partial
;
_diffrn_measurement_device_type
;
Rigaku mm007HF microfocus
;
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_diffrn_source                   'Rigaku Rotating Anode'
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'Re-crystallisation from solvent: dichloromethane'
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.1209P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1663
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_reflns_Friedel_coverage         0.000
_reflns_number_gt                831
_reflns_number_total             1591
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c7gc03437g2.cif
_cod_data_source_block           BN0854
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7229731.cif.
;
_cod_database_code               7229731
_shelx_shelxl_version_number     2016/6
_shelx_res_checksum              49700