Crystallography Open Database

Information card for entry 7063352

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Coordinates	7063352.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H3 F10 O Sb
Calculated formula	C2 H3 F10 O Sb
Title of publication	HF-addition to haloacetyl fluorides in superacidic media
Authors of publication	Steiner, Sebastian; Shafiq, Zurwa M.; Nitzer, Alexander; Hollenwäger, Dirk; Kornath, Andreas J.
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	31
Pages of publication	13846 - 13853
a	6.3267 ± 0.0005 Å
b	7.8117 ± 0.0005 Å
c	8.5217 ± 0.0005 Å
α	85.971 ± 0.005°
β	87.605 ± 0.006°
γ	85.482 ± 0.006°
Cell volume	418.54 ± 0.05 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0349
Residual factor for significantly intense reflections	0.0276
Weighted residual factors for significantly intense reflections	0.0558
Weighted residual factors for all reflections included in the refinement	0.0597
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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