Crystallography Open Database

Information card for entry 7047697

Preview

Coordinates	7047697.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H16 N6 O14 Zn2
Calculated formula	C18 H16 N6 O14 Zn2
Title of publication	Water stable oxalate-based coordination polymers with in situ generated cyclic dipeptides showing high proton conductivity.
Authors of publication	Shi, Jingyu; Li, Jing; Zeng, Hongmei; Zou, Guohong; Zhang, Qinghua; Lin, Zhien
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	43
Pages of publication	15288 - 15292
a	8.4179 ± 0.0003 Å
b	9.1478 ± 0.0004 Å
c	16.4206 ± 0.0005 Å
α	84.686 ± 0.003°
β	84.283 ± 0.003°
γ	71.497 ± 0.003°
Cell volume	1190.65 ± 0.08 Å³
Cell temperature	292.3 ± 0.6 K
Ambient diffraction temperature	292.3 ± 0.6 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	0.0404
Residual factor for significantly intense reflections	0.032
Weighted residual factors for significantly intense reflections	0.0801
Weighted residual factors for all reflections included in the refinement	0.0844
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
229445 (current)	2019-11-17	cif/ Updating files of 7047697, 7047698 Original log message: Adding full bibliography for 7047697--7047698.cif.	7047697.cif
211306	2018-10-04	cif/ Adding structures of 7047697, 7047698 via cif-deposit CGI script.	7047697.cif