Crystallography Open Database

Information card for entry 7224105

Preview

Coordinates	7224105.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H24 N8 O62 Zn13
Calculated formula	C64 H24 N8 O62 Zn13
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	12.882 ± 0.005 Å
b	14.292 ± 0.006 Å
c	16.936 ± 0.008 Å
α	110.255 ± 0.009°
β	99.167 ± 0.011°
γ	106.39 ± 0.009°
Cell volume	2690 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.2034
Residual factor for significantly intense reflections	0.1636
Weighted residual factors for significantly intense reflections	0.4142
Weighted residual factors for all reflections included in the refinement	0.4428
Goodness-of-fit parameter for all reflections included in the refinement	1.47
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.	7224105.cif
175445	2016-02-03	cif/ Adding structures of 7224103, 7224104, 7224105, 7224106, 7224107, 7224108, 7224109, 7224110, 7224111 via cif-deposit CGI script.	7224105.cif