Crystallography Open Database

Information card for entry 1577290

Preview

Coordinates	1577290.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	{eta6,eta'6-[2,3,6,7,9,10-Me6-9,10-DHDBA]}{W(CO)3}2
Chemical name	2-W2
Formula	C24 H22 B2 O6 W2
Calculated formula	C24 H22 B2 O6 W2
Title of publication	Zerovalent transition-metal inverse-sandwich complexes of a diborataanthracene dianion
Authors of publication	Gerstner, Alexander; Arrowsmith, Merle; Dietz, Maximilian; Mihm, Cornelius; Braunschweig, Holger
Journal of publication	Chemical Science
Year of publication	2026
a	7.1087 ± 0.0001 Å
b	10.1577 ± 0.0001 Å
c	16.8094 ± 0.0002 Å
α	90°
β	93.311 ± 0.001°
γ	90°
Cell volume	1211.75 ± 0.03 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0322
Residual factor for significantly intense reflections	0.0312
Weighted residual factors for significantly intense reflections	0.0841
Weighted residual factors for all reflections included in the refinement	0.085
Goodness-of-fit parameter for all reflections included in the refinement	1.109
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Diffraction radiation X-ray symbol	K-L~2,3~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
306070 (current)	2026-05-22	cif/ Adding structures of 1577285, 1577286, 1577287, 1577288, 1577289, 1577290, 1577291, 1577292, 1577293 via cif-deposit CGI script.	1577290.cif