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Information card for entry 4075325
Preview
Coordinates | 4075325.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H54 B5 Ir Ru2 |
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Calculated formula | C30 H54 B5 Ir Ru2 |
SMILES | [IrH]1234567([c]8([c]2([c]5(C)[c]1([c]38C)C)C)C)[BH]12[Ru]3589%10%11([H][Ru]%12%13%14%15%16%17%18([c]%20(C)[c]%15([c]%13(C)[c]%14([c]%12%20C)C)C)[BH]%134([BH]619[BH]%10%17%13)[BH]7%18[H]%16)([c]1([c]%11([c]8([c]5([c]31C)C)C)C)C)[H]2 |
Title of publication | Novel Approach to Multimetal Metallaborane Clusters. Synthesis of Hypoelectronicnido-Cp*3IrRu2B5H9from the Reaction ofarachno-Cp*IrB3H9withnido-(Cp*RuH)2B3H7 |
Authors of publication | Mavunkal, Ipe J.; Noll, Bruce C.; Meijboom, Reinout; Muller, Alfred; Fehlner, Thomas P. |
Journal of publication | Organometallics |
Year of publication | 2006 |
Journal volume | 25 |
Journal issue | 12 |
Pages of publication | 2906 |
a | 12.859 ± 0.0006 Å |
b | 15.3673 ± 0.0008 Å |
c | 17.4863 ± 0.0009 Å |
α | 93.805 ± 0.002° |
β | 100.624 ± 0.002° |
γ | 103.744 ± 0.002° |
Cell volume | 3276.9 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.03 |
Weighted residual factors for all reflections included in the refinement | 0.074 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation probe | x-ray |
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/4075325.html
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Users of the data should acknowledge the original authors of the
structural data.