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Information card for entry 7112652
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Coordinates | 7112652.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Pt-complex |
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Chemical name | Pt-complex |
Formula | C28 H33 B N2 O4 Pt |
Calculated formula | C28 H33 B N2 O4 Pt |
SMILES | [Pt]12(O)([O]([B](OC)(c3[n]1cccc3)c1[n]2cccc1)C)(c1ccccc1)c1ccccc1.O1CCCC1 |
Title of publication | Oxidative C(sp3)-H bond cleavage, C-C and C[double bond, length as m-dash]C coupling at a boron center with O2 as the oxidant mediated by platinum(II) |
Authors of publication | S. Pal; P. Y. Zavalij; A. N. Vedernikov |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 5376 |
a | 8.763 ± 0.0007 Å |
b | 12.1564 ± 0.0009 Å |
c | 13.1947 ± 0.001 Å |
α | 107.216 ± 0.001° |
β | 103.338 ± 0.001° |
γ | 97.3974 ± 0.0011° |
Cell volume | 1276.7 ± 0.17 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0349 |
Residual factor for significantly intense reflections | 0.0265 |
Weighted residual factors for significantly intense reflections | 0.0551 |
Weighted residual factors for all reflections included in the refinement | 0.058 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
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/7112652.html
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