Crystallography Open Database

Information card for entry 7010539

Preview

Coordinates	7010539.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H24 N4 O18 V4
Calculated formula	C24 H24 N4 O18 V4
Title of publication	An unprecedented 2-D rhombic molecular grid with a triangular cavity and a V4O6 cluster as the corner unit
Authors of publication	Xiong, Ren-Gen; Xie, Yong-Rong; You, Xiao-Zeng; Che, Chi-Ming
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	6
Pages of publication	777
a	7.236 ± 0.004 Å
b	12.55 ± 0.007 Å
c	16.764 ± 0.01 Å
α	97.566 ± 0.011°
β	97.065 ± 0.01°
γ	99.265 ± 0.012°
Cell volume	1473.2 ± 1.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0786
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1652
Weighted residual factors for all reflections included in the refinement	0.1963
Goodness-of-fit parameter for all reflections included in the refinement	0.771
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
213973 (current)	2019-03-05	cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries.	7010539.cif
179809	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/05.	7010539.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7010539.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7010539.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7010539.cif