Crystallography Open Database

Information card for entry 7228047

Preview

Coordinates	7228047.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H25 Cd3 Cl O19
Calculated formula	C30 H25 Cd3 Cl O19
Title of publication	Introducing 2-(2-carboxyphenoxy)terephthalic acid as a new versatile building block for design of diverse coordination polymers: Synthesis, structural features, luminescence sensing, and magnetism
Authors of publication	Gu, Jinzhong; Kirillov, Alexander M.; Liang, Xiaoxiao; Cui, Yanhui; Wu, Jiang; Shi, Zi-Fa
Journal of publication	CrystEngComm
Year of publication	2017
a	10.8678 ± 0.0006 Å
b	14.2781 ± 0.0009 Å
c	14.568 ± 0.0006 Å
α	109.047 ± 0.005°
β	103.976 ± 0.004°
γ	90.04 ± 0.005°
Cell volume	2065.7 ± 0.2 Å³
Cell temperature	294.2 ± 0.3 K
Ambient diffraction temperature	294.2 ± 0.3 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0839
Residual factor for significantly intense reflections	0.0731
Weighted residual factors for significantly intense reflections	0.1765
Weighted residual factors for all reflections included in the refinement	0.1812
Goodness-of-fit parameter for all reflections included in the refinement	1.14
Diffraction radiation probe	x-ray
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
195324 (current)	2017-04-11	cif/ Adding structures of 7228036, 7228037, 7228038, 7228039, 7228040, 7228041, 7228042, 7228043, 7228044, 7228045, 7228046, 7228047, 7228048 via cif-deposit CGI script.	7228047.cif