Crystallography Open Database

Information card for entry 4313563

Preview

Coordinates	4313563.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H9 N2 O7.5 P V2
Calculated formula	C12 H9 N2 O7.5 P V2
Title of publication	New Vanadium Phosphate {[(phen)VIVO]2(VV2O5)(HPO4)}n with Chiral Layer Architecture
Authors of publication	Chao Qin; Lin Xu; Yongge Wei; Xinlong Wang; Fengyan Li
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	3107 - 3110
a	9.979 ± 0.002 Å
b	9.886 ± 0.002 Å
c	15.298 ± 0.003 Å
α	90°
β	102.86 ± 0.03°
γ	90°
Cell volume	1471.3 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1123
Residual factor for significantly intense reflections	0.0611
Weighted residual factors for significantly intense reflections	0.1332
Weighted residual factors for all reflections included in the refinement	0.154
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4313563.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4313563.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4313563.cif
6632	2011-01-12	../uploads/cif-deposit/cod/cif Adding structures of 4313563 via cif-deposit CGI script.	4313563.cif