Crystallography Open Database

Information card for entry 4312741

Preview

Coordinates	4312741.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl16 Nb10 O7
Calculated formula	Cl15.968 Nb9.98 O6.986
Title of publication	A Novel Layered Niobium Oxychloride Compound Based on Nb2 Pairs and Nb6 Octahedral Clusters: Synthesis and Crystal and Electronic Structures of Nb10Cl16O7
Authors of publication	Stéphane Cordier; Fakhili Gulo; Thierry Roisnel; Régis Gautier; Boris le Guennic; Jean François Halet; Christiane Perrin
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	8320 - 8327
a	6.514 ± 0.0003 Å
b	8.9728 ± 0.0005 Å
c	11.3463 ± 0.0006 Å
α	77.8032 ± 0.0003°
β	81.731 ± 0.0003°
γ	79.5241 ± 0.0003°
Cell volume	633.56 ± 0.06 Å³
Cell temperature	293 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0479
Weighted residual factors for all reflections included in the refinement	0.094
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4312741.html