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Information card for entry 4068305
Preview
Coordinates | 4068305.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H63 B Fe N2 O Si |
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Calculated formula | C60 H63 B Fe N2 O Si |
SMILES | [Fe]1([O]2CCCC2)([N](=C(c2ccccc2)c2ccccc2)CC[N]1=C(c1ccccc1)c1ccccc1)C[Si](C)(C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Electron-Deficient Iron Alkyl Complexes Supported by Diimine Ligand (Ph2CN)2C2H4: Evidence for Reversible Ethylene Binding |
Authors of publication | Volbeda, Jeroen; Meetsma, Auke; Bouwkamp, Marco W. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 1 |
Pages of publication | 209 |
a | 42.767 ± 0.007 Å |
b | 9.6646 ± 0.0016 Å |
c | 24.712 ± 0.004 Å |
α | 90° |
β | 90.126 ± 0.002° |
γ | 90° |
Cell volume | 10214 ± 3 Å3 |
Cell temperature | 100 ± 1 K |
Ambient diffraction temperature | 100 ± 1 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1115 |
Residual factor for significantly intense reflections | 0.0549 |
Weighted residual factors for significantly intense reflections | 0.1234 |
Weighted residual factors for all reflections included in the refinement | 0.1459 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4068305.html
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