Crystallography Open Database

Information card for entry 8106601

Preview

Coordinates	8106601.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H44 Cl4 Co4 N4 O9
Calculated formula	C17 H44 Cl4 Co4 N4 O9
SMILES	[Co]1234([O]56[Co]78([OH]CC[NH]8CC6)([O]68[Co]9%10([O]17CC[NH]%10CC[OH]9)([O]3([Co]156([OH]CC[NH]1CC8)Cl)CC[NH]4CC[OH]2)Cl)Cl)Cl.OC
Title of publication	Crystal structure of tetrakis(μ3-2-(N-(2-hydroxyethyl)amino)ethoxo)-tetrachloro-tetra-cobalt(II) methanol solvate, C17H44Cl4Co4N4O9
Authors of publication	Yuhua, Guo; Youzhu, Yu; Weiyun, Shi; Aimin, Wei; Fengli, Wang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2017
Journal volume	232
Journal issue	4
Pages of publication	557 - 559
a	10.918 ± 0.014 Å
b	11.899 ± 0.015 Å
c	13.327 ± 0.017 Å
α	91.286 ± 0.013°
β	91.755 ± 0.014°
γ	111.673 ± 0.013°
Cell volume	1607 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.043
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0988
Weighted residual factors for all reflections included in the refinement	0.1257
Goodness-of-fit parameter for all reflections included in the refinement	1.221
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
280634 (current)	2023-01-27	cif/ Adding structures of 8106601 via cif-deposit CGI script.	8106601.cif