Crystallography Open Database

Information card for entry 1576724

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Coordinates	1576724.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H52 F9 N3 O W
Calculated formula	C40 H52 F9 N3 O 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	11.223 ± 0.009 Å
b	12.684 ± 0.01 Å
c	16.267 ± 0.013 Å
α	77.46 ± 0.02°
β	76.31 ± 0.04°
γ	70.79 ± 0.02°
Cell volume	2100 ± 3 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 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	0.063
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.1319
Weighted residual factors for all reflections included in the refinement	0.1462
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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