Crystallography Open Database

Information card for entry 7046674

Preview

Coordinates	7046674.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H58 Mo12 N8 O61 Re Te2
Calculated formula	C3 Mo12 O48 Re Te2
Title of publication	Organometallic functionalized non-classical polyoxometalates: synthesis, characterization and electrochemical properties.
Authors of publication	Zhang, Panpan; Singh, Vikram; Jia, Jiage; Zhang, Dongdi; Ma, Pengtao; Wang, Jingping; Niu, Jingyang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	28
Pages of publication	9317 - 9323
a	30.62 ± 0.002 Å
b	20.108 ± 0.002 Å
c	10.6218 ± 0.0008 Å
α	90°
β	92.232 ± 0.002°
γ	90°
Cell volume	6535 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.041
Residual factor for significantly intense reflections	0.0364
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1009
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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
229203 (current)	2019-11-17	cif/ Updating files of 7046673, 7046674 Original log message: Adding full bibliography for 7046673--7046674.cif.	7046674.cif
208371	2018-06-14	cif/ Adding structures of 7046673, 7046674 via cif-deposit CGI script.	7046674.cif