Crystallography Open Database

Information card for entry 7242748

Preview

Coordinates	7242748.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H18 Cl Co N4 O5
Calculated formula	C14 H18 Cl Co N4 O5
SMILES	[Co]123(OC(=O)C[NH2]1)([NH2]CC(=O)O2)[n]1ccccc1c1[n]3cccc1.[Cl-].O
Title of publication	Towards a selective synthetic route for cobalt amino acid complexes and their application in ring opening polymerization of rac-lactide
Authors of publication	Ruiz, Andrés Castro; Damodaran, Krishna K.; Suman, Sigridur G.
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	27
Pages of publication	16326 - 16338
a	7.8928 ± 0.0007 Å
b	19.9184 ± 0.0017 Å
c	10.8042 ± 0.0009 Å
α	90°
β	106.081 ± 0.003°
γ	90°
Cell volume	1632.1 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0557
Residual factor for significantly intense reflections	0.0386
Weighted residual factors for significantly intense reflections	0.0933
Weighted residual factors for all reflections included in the refinement	0.1017
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
264851 (current)	2021-05-05	cif/ Adding structures of 7242748, 7242749, 7242750, 7242751, 7242752, 7242753, 7242754 via cif-deposit CGI script.	7242748.cif