Crystallography Open Database

Information card for entry 4082264

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Coordinates	4082264.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H33 I Ni O2 P2
Calculated formula	C15 H33 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	8.8178 ± 0.0001 Å
b	12.8678 ± 0.0002 Å
c	18.3162 ± 0.0002 Å
α	90°
β	93.163 ± 0.001°
γ	90°
Cell volume	2075.09 ± 0.05 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0539
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0913
Weighted residual factors for all reflections included in the refinement	0.0957
Goodness-of-fit parameter for all reflections included in the refinement	0.976
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.	4082264.cif
99264	2014-01-30	cif/ Adding structures of 4082264 via cif-deposit CGI script.	4082264.cif