Crystallography Open Database

Information card for entry 4075640

Preview

Coordinates	4075640.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H36 Ni O P2
Calculated formula	C15 H36 Ni O P2
SMILES	[Ni]1([P](CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)(O)C
Title of publication	Fluoride Displacement by Lithium Reagents. An Improved Method for the Synthesis of Nickel Hydroxo, Alkoxo, and Amido Complexes
Authors of publication	Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Graiff, Claudia; Tiripicchio, Antonio
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	12
Pages of publication	2827
a	7.523 ± 0.003 Å
b	18.015 ± 0.005 Å
c	7.514 ± 0.003 Å
α	90.03 ± 0.03°
β	108.2 ± 0.05°
γ	101.82 ± 0.04°
Cell volume	944.6 ± 0.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0595
Weighted residual factors for significantly intense reflections	0.1582
Weighted residual factors for all reflections included in the refinement	0.1725
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178645 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/56.	4075640.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4075640.cif
50597	2012-03-31	../uploads/cif-deposit/cod/cif Adding structures of 4075639, 4075640 via cif-deposit CGI script.	4075640.cif