Crystallography Open Database

Information card for entry 7216732

Preview

Coordinates	7216732.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H64 N12 Na Nb14 O60 V
Calculated formula	C10 H50 N12 Na Nb14 O60 V
Title of publication	New heteropolyniobates based on a bicapped Keggin-type {VNb14} cluster with selective adsorption and photocatalytic properties
Authors of publication	Huang, Peng; Zhou, En-Long; Wang, Xin-Long; Sun, Chun-Yi; Wang, Hai-Ning; Xing, Yan; Shao, Kui-Zhan; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	41
Pages of publication	9582
a	13.041 ± 0.005 Å
b	14.26 ± 0.005 Å
c	20.45 ± 0.005 Å
α	77.812 ± 0.005°
β	78.2 ± 0.005°
γ	66.431 ± 0.005°
Cell volume	3376.4 ± 1.9 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0657
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1298
Weighted residual factors for all reflections included in the refinement	0.1405
Goodness-of-fit parameter for all reflections included in the refinement	1.054
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
180498 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/67.	7216732.cif
124695	2014-10-06	cif/ Updating files of 7216732, 7216733 Original log message: Adding full bibliography for 7216732--7216733.cif.	7216732.cif
117979	2014-06-23	cif/ Adding structures of 7216732, 7216733 via cif-deposit CGI script.	7216732.cif