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Information card for entry 7041333
Preview
Coordinates | 7041333.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H44 Cl2 N2 O6 P2 Pt |
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Calculated formula | C32 H44 Cl2 N2 O6 P2 Pt |
SMILES | [C@]12(C[C@@]3(O[C@@](C[C@](O1)(O3)C)([P]2(c1nc(ccc1)C)[Pt]([P]1([C@]2(C[C@@]3(C)O[C@@]1(C[C@@](O2)(O3)C)C)C)c1nc(ccc1)C)(Cl)Cl)C)C)C |
Title of publication | 2-Pyridyl substituents enhance the activity of palladium-phospha-adamantane catalysts for the methoxycarbonylation of phenylacetylene. |
Authors of publication | Shuttleworth, Timothy A.; Miles-Hobbs, Alexandra M; Pringle, Paul G.; Sparkes, Hazel A. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 46 |
Journal issue | 1 |
Pages of publication | 125 - 137 |
a | 8.7414 ± 0.0002 Å |
b | 10.2111 ± 0.0003 Å |
c | 11.1847 ± 0.0003 Å |
α | 64.6586 ± 0.0013° |
β | 88.5905 ± 0.0015° |
γ | 77.9537 ± 0.0015° |
Cell volume | 880.03 ± 0.04 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0227 |
Residual factor for significantly intense reflections | 0.0225 |
Weighted residual factors for significantly intense reflections | 0.0565 |
Weighted residual factors for all reflections included in the refinement | 0.0566 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/7041333.html
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Users of the data should acknowledge the original authors of the
structural data.