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Information card for entry 7039076
Preview
Coordinates | 7039076.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51 H47 Fe P Sn |
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Calculated formula | C51 H47 Fe P Sn |
SMILES | [Sn](P1C2([Fe]3456789([CH]2=[C]3([CH]4=[C]15c1ccccc1)c1ccccc1)[c]1([c]9([c]8([c]7([c]61C)C)C)C)C)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Reaction of a 2,4,6-triphenylphosphinine ferrate anion with electrophiles: a new route to phosphacyclohexadienyl complexes. |
Authors of publication | Hoidn, Christian M.; Wolf, Robert |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 21 |
Pages of publication | 8875 - 8884 |
a | 13.87702 ± 0.00014 Å |
b | 20.79053 ± 0.0002 Å |
c | 14.68647 ± 0.00016 Å |
α | 90° |
β | 105.53 ± 0.0011° |
γ | 90° |
Cell volume | 4082.5 ± 0.08 Å3 |
Cell temperature | 123.01 ± 0.1 K |
Ambient diffraction temperature | 123 ± 1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0348 |
Residual factor for significantly intense reflections | 0.0331 |
Weighted residual factors for significantly intense reflections | 0.0899 |
Weighted residual factors for all reflections included in the refinement | 0.0912 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7039076.html
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