Crystallography Open Database

Information card for entry 4342234

Preview

Coordinates	4342234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H8 O6 V
Calculated formula	C14 H8 O6 V
Title of publication	Two Distinct Redox Intercalation Reactions of Hydroquinone with Porous Vanadium Benzenedicarboxylate MIL-47.
Authors of publication	Kaveevivitchai, Watchareeya; Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1822 - 1828
a	18.365 ± 0.01 Å
b	6.855 ± 0.004 Å
c	10.38 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	1306.8 ± 1.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	74
Hermann-Mauguin space group symbol	I m m a
Hall space group symbol	-I 2b 2
Residual factor for all reflections	0.11
Residual factor for significantly intense reflections	0.1004
Weighted residual factors for significantly intense reflections	0.2478
Weighted residual factors for all reflections included in the refinement	0.2528
Goodness-of-fit parameter for all reflections included in the refinement	1.253
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
179525 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/22.	4342234.cif
132812	2015-03-04	cif/ Updating files of 4342234, 4342235 Original log message: Adding full bibliography for 4342234--4342235.cif.	4342234.cif
130442	2015-02-04	cif/ Adding structures of 4342234 via cif-deposit CGI script.	4342234.cif