Crystallography Open Database

Information card for entry 7214667

Preview

Coordinates	7214667.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H86 Cu2 Mo12 N12 O56 Si
Calculated formula	C54 H66 Cu2 Mo12 N12 O56 Si
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	11.3637 ± 0.0009 Å
b	12.9558 ± 0.0011 Å
c	16.8671 ± 0.0014 Å
α	100.639 ± 0.001°
β	108.695 ± 0.001°
γ	91.221 ± 0.001°
Cell volume	2303.2 ± 0.3 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	0.0431
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.1024
Weighted residual factors for all reflections included in the refinement	0.1047
Goodness-of-fit parameter for all reflections included in the refinement	1.097
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.	7214667.cif
110940	2014-04-20	cif/ Adding structures of 7214664, 7214665, 7214666, 7214667, 7214668 via cif-deposit CGI script.	7214667.cif