Crystallography Open Database

Information card for entry 4082258

Preview

Coordinates	4082258.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H31 I Ni O2 P2
Calculated formula	C18 H31 I Ni O2 P2
Title of publication	New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel
Authors of publication	Pandarus, Valerica; Zargarian, Davit
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	17
Pages of publication	4321
a	8.395 ± 0.0004 Å
b	10.4148 ± 0.0005 Å
c	13.1212 ± 0.0007 Å
α	81.803 ± 0.003°
β	80.886 ± 0.003°
γ	88.316 ± 0.003°
Cell volume	1121.13 ± 0.1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0908
Residual factor for significantly intense reflections	0.0568
Weighted residual factors for significantly intense reflections	0.1303
Weighted residual factors for all reflections included in the refinement	0.1452
Goodness-of-fit parameter for all reflections included in the refinement	0.899
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178711 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/22.	4082258.cif
99258	2014-01-30	cif/ Adding structures of 4082258 via cif-deposit CGI script.	4082258.cif