Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester.
Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander; Acta crystallographica. Section C, Structural chemistry 80 (2024) 278–283; doi:10.1107/S2053229624005230

data_2312521
_publ_section_title
;
 Crystal structure elucidation of a geminal and vicinal
 bis(trifluoromethanesulfonate) ester.
;
_journal_coeditor_code           OJ3019
_journal_issue                   'Pt 7'
_journal_name_full
'Acta crystallographica. Section C, Structural chemistry'
_journal_page_first              278
_journal_page_last               283
_journal_paper_doi               10.1107/S2053229624005230
_journal_volume                  80
_journal_year                    2024
_chemical_formula_iupac          'C4 H4 F6 O6 S2'
_chemical_formula_sum            'C4 H4 F6 O6 S2'
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_chemical_name_common
;
Ethylene bis(triflate)
;
_chemical_name_systematic
;
Ethane-1,2-diyl bis(trifluoromethanesulfonate)
;
_space_group_crystal_system      triclinic
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;
FinalCif V133 by Daniel Kratzert, Freiburg 2024,
https://dkratzert.de/finalcif.html
;
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;
SAINT (Bruker, 2019)
;
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APEX4 (Bruker, 2022)
;
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SAINT (Bruker, 2019)
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PLATON (Spek, 2020)
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PLATON (Spek, 2020), enCIFer (Allen <i>et al.</i>,  2004) and
<i>FinalCif</i> (Kratzert, 2023)
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SHELXL (Sheldrick, 2015b) and <i>SHELXLE</i> (H\"ubschle <i>et al.</i>,
2011)
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;
<i>SHELXT</i> (Sheldrick, 2015a)
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;
(TWINABS; Bruker, 2012)
;
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'w=1/[\s^2^(Fo^2^)+(0.0356P)^2^+5.6794P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     'I > 2\s(I)'
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'Adding full bibliography for 2312521--2312522.cif.'
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