Crystallography Open Database

Information card for entry 7020804

7020803 << 7020804 >> 7020805

Preview

Coordinates	7020804.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H48 Ni P2 S
Calculated formula	C24 H48 Ni P2 S
SMILES	[NiH](Sc1ccccc1)([P](C(C)C)(C(C)C)C(C)C)[P](C(C)C)(C(C)C)C(C)C
Title of publication	Synthesis and chemistry of bis(triisopropylphosphine) nickel(i) and nickel(0) precursors.
Authors of publication	Beck, Robert; Shoshani, Manar; Krasinkiewicz, Jonathan; Hatnean, Jillian A.; Johnson, Samuel A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	5
Pages of publication	1461 - 1475
a	9.1831 ± 0.0018 Å
b	11.038 ± 0.002 Å
c	13.734 ± 0.003 Å
α	81.49 ± 0.02°
β	88.23 ± 0.03°
γ	84.88 ± 0.03°
Cell volume	1371.1 ± 0.5 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 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	0.0507
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.0951
Weighted residual factors for all reflections included in the refinement	0.1191
Goodness-of-fit parameter for all reflections included in the refinement	1.164
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
179913 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/08.	7020804.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020804.cif
73673	2013-02-21	cif/ Adding structures of 7020791, 7020792, 7020793, 7020794, 7020795, 7020796, 7020797, 7020798, 7020799, 7020800, 7020801, 7020802, 7020803, 7020804, 7020805 via cif-deposit CGI script.	7020804.cif