Crystallography Open Database

Information card for entry 7224104

Preview

Coordinates	7224104.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H18 Br2 N2 O8 Zn2
Calculated formula	C28 H18 Br2 N2 O8 Zn2
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	14.0217 ± 0.0002 Å
b	31.3444 ± 0.0005 Å
c	27.9952 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	12303.9 ± 0.3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.1382
Residual factor for significantly intense reflections	0.1373
Weighted residual factors for significantly intense reflections	0.3158
Weighted residual factors for all reflections included in the refinement	0.3162
Goodness-of-fit parameter for all reflections included in the refinement	1.137
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
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.	7224104.cif
175445	2016-02-03	cif/ Adding structures of 7224103, 7224104, 7224105, 7224106, 7224107, 7224108, 7224109, 7224110, 7224111 via cif-deposit CGI script.	7224104.cif