Crystallography Open Database

Information card for entry 7224103

Preview

Coordinates	7224103.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H12 Br4 O16 Zn3
Calculated formula	C32 H12 Br4 O16 Zn3
Title of publication	Structural diversity of a series of coordination polymers built from 5-substituted isophthalic acid with or without a methyl-functionalized N-donor ligand
Authors of publication	Ma, De-Yun; Qin, Liang; Lei, Jia-Mei; Liang, Yun-Qiu; Lin, Wei-Jie; Yan, Jing-Jing; Ding, Wan-Qiu; Guo, Hai-Fu; Ling, Yun
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	8
Pages of publication	1363
a	20.892 ± 0.01 Å
b	24.47 ± 0.011 Å
c	25.238 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	12902 ± 10 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.126
Residual factor for significantly intense reflections	0.0803
Weighted residual factors for significantly intense reflections	0.2071
Weighted residual factors for all reflections included in the refinement	0.2324
Goodness-of-fit parameter for all reflections included in the refinement	0.958
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
177757 (current)	2016-03-05	cif/ Updating files of 7224103, 7224104, 7224105, 7224106, 7224107, 7224108, 7224109, 7224110, 7224111 Original log message: Adding full bibliography for 7224103--7224111.cif.	7224103.cif
175445	2016-02-03	cif/ Adding structures of 7224103, 7224104, 7224105, 7224106, 7224107, 7224108, 7224109, 7224110, 7224111 via cif-deposit CGI script.	7224103.cif