Crystallography Open Database

Information card for entry 4350314

Preview

Coordinates	4350314.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9.5 H28 F6 N2 O10 P3 V3
Calculated formula	C9.5 H28 F6 N2 O10 P3 V3
Title of publication	Evolution of the structural chemistry of vanadium organodiphosphonate networks and frameworks: structural consequences of fluoride incorporation in the development of stable phases with void channels.
Authors of publication	Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J; Zubieta, Jon
Journal of publication	Inorganic chemistry
Year of publication	2006
Journal volume	45
Journal issue	19
Pages of publication	7628 - 7641
a	7.8942 ± 0.0008 Å
b	9.3578 ± 0.0009 Å
c	17.2016 ± 0.0017 Å
α	99.665 ± 0.002°
β	96.062 ± 0.002°
γ	107.762 ± 0.002°
Cell volume	1176.2 ± 0.2 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0753
Residual factor for significantly intense reflections	0.062
Weighted residual factors for significantly intense reflections	0.1294
Weighted residual factors for all reflections included in the refinement	0.1394
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
239835 (current)	2019-11-25	cif/ Adding structures of 4350312, 4350313, 4350314, 4350315, 4350316 via cif-deposit CGI script.	4350314.cif