Crystallography Open Database

Information card for entry 4071144

Preview

Coordinates	4071144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H33 N Ni P2
Calculated formula	C30 H33 N Ni P2
SMILES	[NiH]12[P](c3ccccc3)(c3ccccc3)c3ccccc3N2c2ccccc2[P]1(C(C)C)C(C)C
Title of publication	Phosphorus and Olefin Substituent Effects on the Insertion Chemistry of Nickel(II) Hydride Complexes Containing Amido Diphosphine Ligands
Authors of publication	Liang, Lan-Chang; Chien, Pin-Shu; Lee, Pei-Ying
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	13
Pages of publication	3082
a	17.922 ± 0.0003 Å
b	8.081 ± 0.0005 Å
c	20.62 ± 0.0007 Å
α	90 ± 0.002°
β	113.842 ± 0.001°
γ	90 ± 0.001°
Cell volume	2731.5 ± 0.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0626
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.096
Weighted residual factors for all reflections included in the refinement	0.1119
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
178600 (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 4/07/11.	4071144.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071144.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071144.cif
43065	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4071141, 4071142, 4071143, 4071144, 4071145, 4071146, 4071147, 4071148 via cif-deposit CGI script.	4071144.cif