Crystallography Open Database

Information card for entry 7214668

Preview

Coordinates	7214668.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H86 Cu2 N12 O56 Si W12
Calculated formula	C54 H66 Cu2 N12 O56 Si W12
Title of publication	Tuning the architectures of polyoxometalate-templated complexes by changing the spacer lengths of bis-pyridyl-bis-amide ligands (L): from 1D chains to 2D networks based on different (CuL)n loops
Authors of publication	Wang, Xiuli; Xu, Chuang; Lin, Hongyan; Liu, Guocheng; Yang, Song; Gao, Qiang; Tian, Aixiang
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	18
Pages of publication	5836
a	11.38 ± 0.002 Å
b	13.015 ± 0.002 Å
c	16.866 ± 0.003 Å
α	101.322 ± 0.002°
β	108.603 ± 0.002°
γ	90.544 ± 0.002°
Cell volume	2314.4 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0552
Residual factor for significantly intense reflections	0.0405
Weighted residual factors for significantly intense reflections	0.0987
Weighted residual factors for all reflections included in the refinement	0.1078
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
180477 (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 7/21/46.	7214668.cif
110940	2014-04-20	cif/ Adding structures of 7214664, 7214665, 7214666, 7214667, 7214668 via cif-deposit CGI script.	7214668.cif