Crystallography Open Database

Information card for entry 7211902

7211901 << 7211902 >> 7211903

Preview

Coordinates	7211902.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H83 Mn2 Mo12 N14 Na3 O69.5 P8
Calculated formula	C35 H56 Mn2 Mo12 N14 Na3 O69.4 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	14.9478 ± 0.0009 Å
b	25.2004 ± 0.0015 Å
c	26.7202 ± 0.0013 Å
α	90°
β	108.671 ± 0.003°
γ	90°
Cell volume	9535.5 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0784
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1332
Weighted residual factors for all reflections included in the refinement	0.1499
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7211902.cif
92478	2014-01-12	cif/ Adding structures of 7211901, 7211902 via cif-deposit CGI script.	7211902.cif