Crystallography Open Database

Information card for entry 7024244

Preview

Coordinates	7024244.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31.5 H28.5 Cr N O4.5 P2
Calculated formula	C31.5 H28.5 Cr N O4.5 P2
Title of publication	Ligand effects in chromium diphosphine catalysed olefin co-trimerisation and diene trimerisation.
Authors of publication	Bowen, Lucy E.; Charernsuk, Manutsavin; Hey, Thomas W.; McMullin, Claire L.; Orpen, A. Guy; Wass, Duncan F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	2
Pages of publication	560 - 567
a	9.9443 ± 0.0004 Å
b	15.8753 ± 0.0007 Å
c	38.8284 ± 0.0015 Å
α	90°
β	101.416 ± 0.001°
γ	90°
Cell volume	6008.5 ± 0.4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.1147
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.1654
Weighted residual factors for all reflections included in the refinement	0.1882
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179947 (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 7/02/42.	7024244.cif
92301	2014-01-12	cif/ Adding structures of 7024244, 7024245, 7024246, 7024247 via cif-deposit CGI script.	7024244.cif