Crystallography Open Database

Information card for entry 4337124

Preview

Coordinates	4337124.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32.5 H44 Al Mo14 N5 O46
Calculated formula	C32.5 H32 Al Mo14 N5 O46
Title of publication	An Unusual Metallic Oxygen Cluster Consisting of a {AlMo12O40(MoO2)}.
Authors of publication	Han, Zhan-Gang; Chang, Xiao-Qing; Yan, Jin-Shuang; Gong, Kai-Ning; Zhao, Chuan; Zhai, Xue-Liang
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	2
Pages of publication	670 - 672
a	12.6215 ± 0.0013 Å
b	13.7714 ± 0.0014 Å
c	20.966 ± 0.002 Å
α	86.845 ± 0.002°
β	75.441 ± 0.001°
γ	65.095 ± 0.001°
Cell volume	3193.8 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0553
Residual factor for significantly intense reflections	0.0419
Weighted residual factors for significantly intense reflections	0.1102
Weighted residual factors for all reflections included in the refinement	0.12
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4337124.cif
106173	2014-03-15	cif/ Adding structures of 4337124 via cif-deposit CGI script.	4337124.cif