Crystallography Open Database

Information card for entry 4116259

Preview

Coordinates	4116259.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H45 Cl U
Calculated formula	C30 H45 Cl U
Title of publication	How Much Steric Crowding Is Possible in Tris(η5-pentamethylcyclopentadienyl) Complexes? Synthesis and Structure of (C5Me5)3UCl and (C5Me5)3UF1
Authors of publication	William J. Evans; Gregory W. Nyce; Matthew A. Johnston; Joseph W. Ziller
Journal of publication	Journal of the American Chemical Society
Year of publication	2000
Journal volume	122
Pages of publication	12019 - 12020
a	9.9903 ± 0.0003 Å
b	9.9903 ± 0.0003 Å
c	15.3902 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	1330.25 ± 0.08 Å³
Cell temperature	158 ± 2 K
Ambient diffraction temperature	158 ± 2 K
Number of distinct elements	4
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.056
Residual factor for significantly intense reflections	0.05
Weighted residual factors for significantly intense reflections	0.1215
Weighted residual factors for all reflections included in the refinement	0.1247
Goodness-of-fit parameter for all reflections included in the refinement	1.398
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/4116259.html