Crystallography Open Database

Information card for entry 1516937

Preview

Coordinates	1516937.cif

Structure parameters

Formula	C15 H14 N3 O5 Zn
Calculated formula	C15 H14 N3 O5 Zn
Title of publication	A series of transition coordination polymers assembled by asymmetric dicarboxylic acid and flexible bridging ligand: Structural diversities, topologies and properties
Authors of publication	Wang, Yan; Liu, Zhiqing; Zhou, Juhong; Wang, Tao; Wang, Suna; Liu, Guangxiang; Wang, Xiaoxiao; Gao, Ya; Xu, Jing
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	400
Pages of publication	169 - 178
a	28.218 ± 0.002 Å
b	10.8849 ± 0.0011 Å
c	10.7915 ± 0.0009 Å
α	90°
β	106.817 ± 0.001°
γ	90°
Cell volume	3172.9 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0455
Residual factor for significantly intense reflections	0.0299
Weighted residual factors for significantly intense reflections	0.0663
Weighted residual factors for all reflections included in the refinement	0.0723
Goodness-of-fit parameter for all reflections included in the refinement	0.972
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1516937.cif
119706	2014-07-08	cif/ Adding structures of 1516937 via cif-deposit CGI script.	1516937.cif