Crystallography Open Database

Information card for entry 7202022

7202021 << 7202022 >> 7202023

Preview

Coordinates	7202022.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H48 Cu4 N24 O50 P W12
Calculated formula	C28 H16 Cu4 N24 O50 P W12
Title of publication	A novel (4,8)-connected 3D polyoxometalate-based metal‒organic framework containing an in situ ligand
Authors of publication	Lan, Ya-Qian; Li, Shun-Li; Li, Yang-Guang; Su, Zhong-Min; Shao, Kui-Zhan; Wang, Xin-Long
Journal of publication	CrystEngComm
Year of publication	2008
Journal volume	10
Journal issue	9
Pages of publication	1129
a	15.3782 ± 0.0019 Å
b	16.46 ± 0.002 Å
c	20.12 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5092.9 ± 1.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	71
Hermann-Mauguin space group symbol	I m m m
Hall space group symbol	-I 2 2
Residual factor for all reflections	0.0779
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1687
Weighted residual factors for all reflections included in the refinement	0.1821
Goodness-of-fit parameter for all reflections included in the refinement	1.066
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
180351 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/20.	7202022.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7202022.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7202022.cif
1173	2010-05-16	cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing.	7202022.cif