Crystallography Open Database

Information card for entry 7113151

Preview

Coordinates	7113151.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H58 Cu3 N16 O27 V10
Calculated formula	C40 H56 Cu3 N16 O27 V10
Title of publication	Spontaneous resolution of a 3D chiral polyoxometalate-based polythreaded framework consisting of an achiral ligand
Authors of publication	Lan, Ya-Qian; Li, Shun-Li; Su, Zhong-Min; Shao, Kui-Zhan; Ma, Jian-Fang; Wang, Xin-Long; Wang, En-Bo
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2008
Journal issue	1
Pages of publication	58 - 60
a	23.067 ± 0.0014 Å
b	23.176 ± 0.0014 Å
c	24.948 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	13337.2 ± 1.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	23
Hermann-Mauguin space group symbol	I 2 2 2
Hall space group symbol	I 2 2
Residual factor for all reflections	0.0868
Residual factor for significantly intense reflections	0.0549
Weighted residual factors for significantly intense reflections	0.1107
Weighted residual factors for all reflections included in the refinement	0.1269
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Duplicate of	7102778
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7113151.html