Crystallography Open Database

Information card for entry 7707201

Preview

Coordinates	7707201.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H44 Cu4 K N14 Nb9 O42 Te V2
Calculated formula	C42 H44 Cu4 K N14 Nb9 O42 Te V2
Title of publication	Synthesis, structures and stability of three V-substituted polyoxoniobate clusters based on [TeNb<sub>9</sub>O<sub>33</sub>]<sup>17-</sup> units.
Authors of publication	Yang, Zongfei; Shang, Jingjing; Yang, Yuanyuan; Ma, Pengtao; Niu, Jingyang; Wang, Jingping
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	22
Pages of publication	7610 - 7620
a	15.4162 ± 0.0015 Å
b	18.938 ± 0.0017 Å
c	21.0858 ± 0.0019 Å
α	63.501 ± 0.002°
β	71.908 ± 0.003°
γ	84.15 ± 0.003°
Cell volume	5232.1 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	149.98 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1415
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.1633
Weighted residual factors for all reflections included in the refinement	0.2055
Goodness-of-fit parameter for all reflections included in the refinement	0.985
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
267158 (current)	2021-07-05	cif/ Updating files of 7707201, 7707202, 7707203 Original log message: Adding full bibliography for 7707201--7707203.cif.	7707201.cif
264607	2021-04-28	cif/ Adding structures of 7707201, 7707202, 7707203 via cif-deposit CGI script.	7707201.cif