Crystallography Open Database

Information card for entry 7218049

Preview

Coordinates	7218049.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H16 N2 O4 P Zn
Calculated formula	C14 H16 N2 O4 P Zn
Title of publication	Two polymorphs of zinc(ii) coordination polymers constructed from 2-carboxyethyl(phenyl)phosphinate and 1,4-bis(1H-imidazol-1-yl)butane ligands
Authors of publication	Zhou, Ming-Jie; Li, Bing; Liu, Li; Feng, Yan-Long; Guo, Jian-Zhong
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	43
Pages of publication	10034
a	33.174 ± 0.007 Å
b	5.5878 ± 0.0011 Å
c	20.516 ± 0.004 Å
α	90°
β	127.93 ± 0.03°
γ	90°
Cell volume	2999.7 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0896
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1083
Weighted residual factors for all reflections included in the refinement	0.1562
Goodness-of-fit parameter for all reflections included in the refinement	1.144
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
180511 (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 7/21/80.	7218049.cif
126363	2014-11-06	cif/ Updating files of 7218049, 7218050 Original log message: Adding full bibliography for 7218049--7218050.cif.	7218049.cif
123652	2014-09-10	cif/ Adding structures of 7218049, 7218050 via cif-deposit CGI script.	7218049.cif