Crystallography Open Database

Information card for entry 4515787

Preview

Coordinates	4515787.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H45 Cl N P3 W
Calculated formula	C21 H45 Cl N P3 W
Title of publication	Exploration of Homogeneous Ethylene Dimerization Mediated by Tungsten Mono(imido) Complexes
Authors of publication	Messinis, Antonis M.; Wright, William R. H.; Batsanov, Andrei S.; Howard, Judith A. K.; Hanton, Martin J.; Dyer, Philip W.
Journal of publication	ACS Catalysis
Year of publication	2018
Journal volume	8
Journal issue	12
Pages of publication	11235
a	15.7347 ± 0.0005 Å
b	13.6973 ± 0.0004 Å
c	12.7686 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2751.93 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0577
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1297
Weighted residual factors for all reflections included in the refinement	0.1311
Goodness-of-fit parameter for all reflections included in the refinement	1.386
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
225905 (current)	2019-11-10	cif/ Adding structures of 4515780, 4515781, 4515782, 4515783, 4515784, 4515785, 4515786, 4515787, 4515788, 4515789 via cif-deposit CGI script.	4515787.cif