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Information card for entry 7025078
Preview
Coordinates | 7025078.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | pge0812 |
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Formula | C30 H47 Cl2 N P2 Pt |
Calculated formula | C30 H47 Cl2 N P2 Pt |
SMILES | CC1(C)[C@@H](C)[C@H]2CC[C@@H]1C[P@@]12Cc2ccccc2C[P@]2(C[C@@H]3C(C)(C)[C@@H](C)[C@H]2CC3)[Pt]1(Cl)Cl.CC#N |
Title of publication | Synthesis of (1R,4S,6R)-5,5,6-trimethyl-2-phosphabicyclo[2.2.2]octane and derivatives. |
Authors of publication | Edwards, Peter G.; Knight, James C.; Newman, Paul D. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 16 |
Pages of publication | 3851 - 3860 |
a | 7.922 ± 0.0001 Å |
b | 21.3381 ± 0.0003 Å |
c | 18.4545 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3119.56 ± 0.08 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0664 |
Residual factor for significantly intense reflections | 0.056 |
Weighted residual factors for significantly intense reflections | 0.1273 |
Weighted residual factors for all reflections included in the refinement | 0.1342 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
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/7025078.html
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