Crystallography Open Database

Information card for entry 4307565

Preview

Coordinates	4307565.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H14 F5 N2 O V
Calculated formula	C4 H12 F5 N2 O V
Title of publication	Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures
Authors of publication	David W. Aldous; Nicholas F. Stephens; Philip Lightfoot
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	3996 - 4001
a	11.447 ± 0.003 Å
b	5.91 ± 0.002 Å
c	13.58 ± 0.006 Å
α	90°
β	91.54 ± 0.02°
γ	90°
Cell volume	918.4 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0673
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1305
Weighted residual factors for all reflections included in the refinement	0.1393
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.8462 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179113 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/75.	4307565.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307565.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307565.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307565.cif