Crystallography Open Database

Information card for entry 2022162

2022161 << 2022162 >> 2022163

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Structure parameters

Chemical name	(<i>L</i>-Prolinato-κ^2^<i>N</i>,<i>O</i>)(triethylenetetramine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')cobalt(III) chloride perchlorate
Formula	C10 H25 Cl2 Co N6 O7
Calculated formula	C10 H25 Cl2 Co N6 O7
SMILES	[Co]1234(OC(=O)C([NH2]4)CC(=O)N)[N](CC[NH2]1)(CC[NH2]2)CC[NH2]3.[Cl-].Cl(=O)(=O)(=O)[O-]
Title of publication	Reactivity trends of cobalt(III) complexes towards various amino acids based on the properties of the amino acid alkyl chains
Authors of publication	Arderne, Charmaine; Batchelor, Kyle Fraser; Uprety, Bhawna; Chandran, Rahul; Abrahamse, Heidi
Journal of publication	Acta Crystallographica Section C
Year of publication	2020
Journal volume	76
Journal issue	7
a	11.5455 ± 0.0006 Å
b	11.8865 ± 0.0006 Å
c	25.3868 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	3484 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	6
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	0.0949
Residual factor for significantly intense reflections	0.0492
Weighted residual factors for significantly intense reflections	0.0768
Weighted residual factors for all reflections included in the refinement	0.0872
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
252977 (current)	2020-06-06	cif/ hkl/ Adding structures of 2022160, 2022161, 2022162 via cif-deposit CGI script.	2022162.cif 2022162.hkl