Crystallography Open Database

Information card for entry 1561218

Preview

Coordinates	1561218.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H24 Co2 N3 O13.5
Calculated formula	C18 H13 Co2 N3 O8
Title of publication	Three 3D metal coordination polymers based on triazol-functionalized rigid ligand: Synthesis, topological structure and properties
Authors of publication	Meng, Lingkun; Liu, Kang; Liang, Chen; Guo, Xiaolei; Han, Xu; Ren, Siyuan; Ma, Dingxuan; Li, Guanghua; Shi, Zhan; Feng, Shouhua
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	258
Pages of publication	56 - 63
a	14.932 ± 0.003 Å
b	17.072 ± 0.003 Å
c	21.282 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5425.2 ± 1.8 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	0.0433
Residual factor for significantly intense reflections	0.0319
Weighted residual factors for significantly intense reflections	0.0725
Weighted residual factors for all reflections included in the refinement	0.0754
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
263256 (current)	2021-03-23	cif/ Adding structures of 1561217, 1561218, 1561219 via cif-deposit CGI script.	1561218.cif