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Information card for entry 4073410
Preview
Coordinates | 4073410.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H60 Th2 |
---|---|
Calculated formula | C50 H60 Th2 |
SMILES | [CH]12=[CH]3[CH]4=[CH]5[CH]6=[CH]7[CH]8[Th]1345679%10%11%12%13([c]1([c]9([c]%10([c]%11([c]1%12C)C)C)C)C)([CH]1=[CH]%13[CH](=[CH]3C=CC=C1)[Th]145679%10%11%12%13%143([c]3([c]%11([c]%12([c]%13([c]3%14C)C)C)C)C)[CH]3=[CH]9[CH]7=[CH]6[CH]5=[CH]4[CH]%10=[CH]13)[CH]2=8.c1ccccc1 |
Title of publication | Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2 |
Authors of publication | Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L. |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Journal issue | 14 |
Pages of publication | 3568 |
a | 15.372 ± 0.007 Å |
b | 9.907 ± 0.004 Å |
c | 13.781 ± 0.006 Å |
α | 90° |
β | 103.242 ± 0.007° |
γ | 90° |
Cell volume | 2042.9 ± 1.5 Å3 |
Cell temperature | 163 ± 2 K |
Ambient diffraction temperature | 163 ± 2 K |
Number of distinct elements | 3 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0308 |
Residual factor for significantly intense reflections | 0.0273 |
Weighted residual factors for significantly intense reflections | 0.0695 |
Weighted residual factors for all reflections included in the refinement | 0.0716 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4073410.html
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