Crystallography Open Database

Information card for entry 7224109

Preview

Coordinates	7224109.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H36 N4 O12 Zn2
Calculated formula	C28 H36 N4 O12 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	9.919 ± 0.006 Å
b	16.851 ± 0.01 Å
c	10.145 ± 0.006 Å
α	90°
β	93.18 ± 0.011°
γ	90°
Cell volume	1693.1 ± 1.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1087
Residual factor for significantly intense reflections	0.0651
Weighted residual factors for significantly intense reflections	0.1509
Weighted residual factors for all reflections included in the refinement	0.1771
Goodness-of-fit parameter for all reflections included in the refinement	0.977
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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.	7224109.cif
175445	2016-02-03	cif/ Adding structures of 7224103, 7224104, 7224105, 7224106, 7224107, 7224108, 7224109, 7224110, 7224111 via cif-deposit CGI script.	7224109.cif