Crystallography Open Database

Information card for entry 4330288

Preview

Coordinates	4330288.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	tetrakis(dmpu)oxovanadium(IV) triflate
Chemical name	tetrakis(N,N-dimethylpropyleneurea)oxovanadium(IV) trifluoromethanesulfonate
Formula	C26 H48 F6 N8 O11 S2 V
Calculated formula	C26 H48 F6 N8 O11 S2 V
Title of publication	A Coordination Chemistry Study of Hydrated and Solvated Cationic Vanadium Ions in Oxidation States +III, +IV, and +V in Solution and Solid State
Authors of publication	Joanna Krakowiak; Daniel Lundberg; Ingmar Persson
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9598 - 9609
a	16.59 ± 0.004 Å
b	27.137 ± 0.006 Å
c	18.215 ± 0.004 Å
α	90°
β	98.667 ± 0.005°
γ	90°
Cell volume	8107 ± 3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	7
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	0.2013
Residual factor for significantly intense reflections	0.0904
Weighted residual factors for significantly intense reflections	0.2299
Weighted residual factors for all reflections included in the refinement	0.2948
Goodness-of-fit parameter for all reflections included in the refinement	0.931
Diffraction radiation probe	x-ray
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
179405 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/02.	4330288.cif
171491	2015-12-13	cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4.	4330288.cif
79541	2013-04-05	cif/ Adding structures of 4330288 via cif-deposit CGI script.	4330288.cif