Crystallography Open Database

Information card for entry 7054165

Preview

Coordinates	7054165.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H69 Cl2 N4 O21.5 Zn4
Calculated formula	C54 H69 Cl2 N4 O21.5 Zn4
Title of publication	Selective sensing of dihydrogen phosphate anion by a fluorescent tetranuclear pentacoordinated zinc(ii) complex
Authors of publication	Chen, Zhanfen; Wang, Xiaoyong; Chen, Jingwen; Yang, Xiaoliang; Li, Yizhi; Guo, Zijian
Journal of publication	New Journal of Chemistry
Year of publication	2007
Journal volume	31
Journal issue	3
Pages of publication	357
a	12.261 ± 0.005 Å
b	13.887 ± 0.006 Å
c	20.738 ± 0.008 Å
α	89.996 ± 0.007°
β	88.163 ± 0.007°
γ	85.016 ± 0.007°
Cell volume	3516 ± 2 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0884
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.1207
Weighted residual factors for all reflections included in the refinement	0.1268
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
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.	7054165.cif
113440	2014-05-12	cif/ Adding structures of 7054165 via cif-deposit CGI script.	7054165.cif