Crystallography Open Database

Information card for entry 7211901

7211900 << 7211901 >> 7211902

Preview

Coordinates	7211901.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H64 Mn3 Mo12 N8 O69 P8
Calculated formula	C8 H40 Mn3 Mo12 N8 O69 P8
Title of publication	Two organic‒inorganic hybrid frameworks with helical structures and large cavities constructed from poly(oxomolybdophosphates)
Authors of publication	Hao, Zhaomin; Dong, Qingsong; Zhang, Ling; Zhang, Yi; Luo, Fang
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	3
Pages of publication	977
a	16.28 ± 0.011 Å
b	11.924 ± 0.008 Å
c	18.04 ± 0.012 Å
α	90°
β	103.862 ± 0.008°
γ	90°
Cell volume	3400 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0566
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.0994
Weighted residual factors for all reflections included in the refinement	0.1085
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
180450 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/19.	7211901.cif
92478	2014-01-12	cif/ Adding structures of 7211901, 7211902 via cif-deposit CGI script.	7211901.cif