Crystallography Open Database

Information card for entry 4333551

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Structure parameters

Formula	C37 H67 Co2 F6 N2 O P4
Calculated formula	C37 H67 Co2 F6 N2 O P4
Title of publication	Metal-Metal Bonding in Low-Coordinate Dicobalt Complexes Supported by Phosphinoamide Ligands
Authors of publication	Ramyaa Mathialagan; Subramaniam Kuppuswamy; Alexandra T. De Denko; Mark W. Bezpalko; Bruce M. Foxman; Christine M. Thomas
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	701 - 706
a	11.0817 ± 0.0016 Å
b	12.3347 ± 0.0016 Å
c	18.134 ± 0.003 Å
α	87.776 ± 0.009°
β	78.776 ± 0.009°
γ	64.197 ± 0.008°
Cell volume	2185.9 ± 0.6 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0693
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for all reflections	0.0785
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0785
Goodness-of-fit parameter for all reflections included in the refinement	1
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
301839 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure.	4333551.cif
176432	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4333551.cif
99346	2014-01-31	cif/ Adding structures of 4333551 via cif-deposit CGI script.	4333551.cif