Crystallography Open Database

Information card for entry 7217731

Preview

Coordinates	7217731.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 N2 O5 Zn
Calculated formula	C16 H14 N2 O5 Zn
Title of publication	Three-dimensional coordination polymers constructed from C2-symmetric linkers of pyridyl dicarboxylate ligands
Authors of publication	Yun, Ruirui; luo, shizhong; Jiang, Yaqin; Chen, Cheng
Journal of publication	RSC Advances
Year of publication	2014
a	11.877 ± 0.002 Å
b	13.855 ± 0.003 Å
c	13.921 ± 0.003 Å
α	90°
β	114.403 ± 0.002°
γ	90°
Cell volume	2086.1 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0371
Residual factor for significantly intense reflections	0.0311
Weighted residual factors for significantly intense reflections	0.0843
Weighted residual factors for all reflections included in the refinement	0.0861
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
180508 (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 7/21/77.	7217731.cif
121933	2014-08-14	cif/ Adding structures of 7217731 via cif-deposit CGI script.	7217731.cif