Crystallography Open Database

Information card for entry 4513211

Preview

Coordinates	4513211.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H15 N2 O4 S Zn
Calculated formula	C16 H15 N2 O4 S Zn
Title of publication	A Series of Zinc(II) 3D →3D Interpenetrated Coordination Polymers Based On Thiophene-2,5-dicarboxylate and Bis(Imidazole) Derivative Linkers
Authors of publication	Erer, Hakan; Yeşilel, Okan Zafer; Arıcı, Mürsel
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	7
Pages of publication	3201
a	10.151 Å
b	13.086 Å
c	13.062 Å
α	90°
β	94.93°
γ	90°
Cell volume	1728.69 Å³
Cell temperature	145 ± 2 K
Ambient diffraction temperature	145 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0275
Residual factor for significantly intense reflections	0.0252
Weighted residual factors for significantly intense reflections	0.069
Weighted residual factors for all reflections included in the refinement	0.0701
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
141316 (current)	2015-07-08	cif/ Updating files of 4513206, 4513207, 4513208, 4513209, 4513210, 4513211, 4513212 Original log message: Adding full bibliography for 4513206--4513212.cif.	4513211.cif
139127	2015-06-13	cif/ Adding structures of 4513206, 4513207, 4513208, 4513209, 4513210, 4513211, 4513212 via cif-deposit CGI script.	4513211.cif