Crystallography Open Database

Information card for entry 7046673

Preview

Coordinates	7046673.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H56 Mn Mo12 N5 O66 Te2
Calculated formula	C3 Mn Mo12 O48 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	10.5921 ± 0.001 Å
b	20.293 ± 0.002 Å
c	28.55 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	6136.7 ± 1.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0325
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0609
Weighted residual factors for all reflections included in the refinement	0.0628
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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.	7046673.cif
208371	2018-06-14	cif/ Adding structures of 7046673, 7046674 via cif-deposit CGI script.	7046673.cif