Crystallography Open Database

Information card for entry 7037578

Preview

Coordinates	7037578.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H54 Mn2 N7 O55 P V18
Calculated formula	C3 H12 Mn2 N7 O55 P V18
Title of publication	Design and synthesis of purely inorganic 3D frameworks composed of reduced vanadium clusters and manganese linkers.
Authors of publication	Zhou, Yang-Yang; Yao, Shuang; Yan, Jing-Hui; Chen, Li; Wang, Ting-Ting; Wang, Chun-Jie; Zhang, Zhi-Ming
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	47
Pages of publication	20435 - 20440
a	12.1286 ± 0.0019 Å
b	20.336 ± 0.003 Å
c	21.324 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5259.5 ± 1.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0668
Residual factor for significantly intense reflections	0.0544
Weighted residual factors for significantly intense reflections	0.1469
Weighted residual factors for all reflections included in the refinement	0.1564
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
170876 (current)	2015-12-07	cif/ Adding structures of 7037578, 7037579 via cif-deposit CGI script.	7037578.cif