Crystallography Open Database

Information card for entry 2241330

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Structure parameters

Chemical name	Tris(<i>N</i>-methylsalicylaldiminato-κ^2^<i>N</i>,<i>O</i>)vanadium(III)
Formula	C24 H24 N3 O3 V
Calculated formula	C24 H24 N3 O3 V
SMILES	[V]123(Oc4c(cccc4)C=[N]1C)(Oc1c(cccc1)C=[N]2C)Oc1c(cccc1)C=[N]3C
Title of publication	Crystal structure of tris(<i>N</i>-methylsalicylaldiminato-κ^2^<i>N</i>,<i>O</i>)vanadium(III)
Authors of publication	Hilbert, Jessica; Kabus, Sven; Näther, Christian; Bensch, Wolfgang
Journal of publication	Acta Crystallographica Section E
Year of publication	2015
Journal volume	71
Journal issue	12
Pages of publication	m225
a	7.7414 ± 0.0003 Å
b	26.0018 ± 0.0007 Å
c	11.1004 ± 0.0004 Å
α	90°
β	103.265 ± 0.003°
γ	90°
Cell volume	2174.79 ± 0.13 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	5
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	0.0491
Residual factor for significantly intense reflections	0.0395
Weighted residual factors for significantly intense reflections	0.0976
Weighted residual factors for all reflections included in the refinement	0.1021
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181914 (current)	2016-04-06	hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/13.	2241330.cif 2241330.hkl
170408	2015-11-19	cif/ hkl/ Adding structures of 2241330 via cif-deposit CGI script.	2241330.cif 2241330.hkl