Crystallography Open Database

Information card for entry 4335156

Preview

Coordinates	4335156.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F4 H3 O3 Re
Calculated formula	F4 H2 O3 Re
Title of publication	Synthesis and Lewis Acid Properties of (ReO3F)∞and the X-ray Crystal Structures of (HF)2ReO3F.HF and [N(CH3)4]2-[{ReO3(μ-F)}3(μ3-O)].CH3CN
Authors of publication	Maria V. Ivanova; Tobias Köchner; Hélène P. A. Mercier; Gary J. Schrobilgen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	6806 - 6819
a	4.9381 ± 0.0003 Å
b	4.9392 ± 0.0003 Å
c	20.7159 ± 0.0011 Å
α	90°
β	91.906 ± 0.002°
γ	90°
Cell volume	504.99 ± 0.05 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0438
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0902
Weighted residual factors for all reflections included in the refinement	0.0931
Goodness-of-fit parameter for all reflections included in the refinement	1.171
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179454 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/51.	4335156.cif
101063	2014-02-10	cif/ Adding structures of 4335156 via cif-deposit CGI script.	4335156.cif