Crystallography Open Database

Information card for entry 1562600

Preview

Coordinates	1562600.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H28 N4 O6 Zn
Calculated formula	C34 H28 N4 O6 Zn
SMILES	C1(c2c(cccc2)NC(=O)C(=C)C)=[O][Zn]23([n]4cccc5c4c4[n]2cccc4cc5)(O1)[O]=C(c1c(cccc1)NC(=O)C(=C)C)O3
Title of publication	Synthesis, structures of four coordination compounds constructed from o-methacrylamidobenzoic acid and their relationship between structure and solid state luminescence
Authors of publication	Chen, Hong-Xia; Ma, Yong; Zhou, Feng; Wu, Bing; Xu, Qing-Feng; Lu, Jian-Mei; Ge, Jian-Feng
Journal of publication	Journal of Solid State Chemistry
Year of publication	2013
Journal volume	203
Pages of publication	1 - 7
a	20.608 ± 0.004 Å
b	15.235 ± 0.003 Å
c	9.4214 ± 0.0016 Å
α	90°
β	102.59 ± 0.005°
γ	90°
Cell volume	2886.8 ± 0.9 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 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	0.1227
Residual factor for significantly intense reflections	0.069
Weighted residual factors for significantly intense reflections	0.1131
Weighted residual factors for all reflections included in the refinement	0.1322
Goodness-of-fit parameter for all reflections included in the refinement	1.119
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265274 (current)	2021-05-17	cif/ Adding structures of 1562600, 1562601, 1562602, 1562603 via cif-deposit CGI script.	1562600.cif