Crystallography Open Database

Information card for entry 4349690

Preview

Coordinates	4349690.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H18 Cl N W
Calculated formula	C11 H18 Cl N W
Title of publication	Selective ethylene oligomerisation using supported tungsten mono-imido catalysts
Authors of publication	Wright, Christopher M. R.; Williams, Thomas J.; Turner, Zoë R.; Buffet, Jean-Charles; O'Hare, Dermot
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2017
Journal volume	4
Journal issue	6
Pages of publication	1048
a	21.1055 ± 0.0003 Å
b	7.2526 ± 0.0001 Å
c	17.4808 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	2675.78 ± 0.07 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 0.5 K
Number of distinct elements	5
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	0.0461
Residual factor for significantly intense reflections	0.0431
Weighted residual factors for significantly intense reflections	0.1187
Weighted residual factors for all reflections included in the refinement	0.122
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
235747 (current)	2019-11-24	cif/ Adding structures of 4349690, 4349691, 4349692, 4349693, 4349694, 4349695, 4349696, 4349697, 4349698, 4349699, 4349700, 4349701 via cif-deposit CGI script.	4349690.cif