Energy frameworks and a topological analysis of the supramolecular features in in situ cryocrystallized liquids: tuning the weak interaction landscape via fluorination.
Dey, Dhananjay; Bhandary, Subhrajyoti; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak; Physical chemistry chemical physics : PCCP 18 (2016) 31811–31820; doi:10.1039/c6cp05917a

data_7226977
_publ_section_title
;
 Energy frameworks and a topological analysis of the supramolecular
 features in in situ cryocrystallized liquids: tuning the weak interaction
 landscape via fluorination.
;
_journal_issue                   46
_journal_name_full               'Physical chemistry chemical physics : PCCP'
_journal_page_first              31811
_journal_page_last               31820
_journal_paper_doi               10.1039/c6cp05917a
_journal_volume                  18
_journal_year                    2016
_chemical_formula_sum            'C7 H2 Cl F3 O'
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;
2016-08-09 deposited with the CCDC.
2016-10-31 downloaded from the CCDC.
;
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'w=1/[\s^2^(Fo^2^)+(0.0315P)^2^+1.4899P] 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 7226976--7226978.cif.'
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