Crystallography Open Database

Information card for entry 1576722

Preview

Coordinates	1576722.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H40 F18 N2 O2 W
Calculated formula	C34 H40 F18 N2 O2 W
Title of publication	Formation of tungsten ethylidene complexes from diethyl complexes through a proton-catalyzed rearrangement of ethylene.
Authors of publication	Maji, Milan; Zeng, Landley; Schrock, Richard R.; Conley, Matthew P.; Carta, Veronica
Journal of publication	Chemical science
Year of publication	2026
Journal volume	17
Journal issue	1
Pages of publication	421 - 429
a	10.5049 ± 0.0009 Å
b	13.561 ± 0.0011 Å
c	13.6443 ± 0.0011 Å
α	87.086 ± 0.005°
β	87.639 ± 0.006°
γ	81.043 ± 0.006°
Cell volume	1916.4 ± 0.3 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0791
Residual factor for significantly intense reflections	0.0665
Weighted residual factors for significantly intense reflections	0.1687
Weighted residual factors for all reflections included in the refinement	0.1793
Goodness-of-fit parameter for all reflections included in the refinement	1.094
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1576722.html