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Information card for entry 7044726
Preview
| Coordinates | 7044726.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H58 O2 P2 Pd S2 |
|---|---|
| Calculated formula | C54 H58 O2 P2 Pd S2 |
| Title of publication | Regioisomerism in coordination chemistry: oxidative addition of bifunctional ligand to palladium, stabilized with 1,2-bis(diphenylphosphino)ethane |
| Authors of publication | Martyanov, Konstantin A.; Cherkasov, Vladimir Kuz'mich; Abakumov, Gleb Arsent'evich; Baranov, Evgeny V.; Shavyrin, Andrey; Kuropatov, Viacheslav |
| Journal of publication | Dalton Transactions |
| Year of publication | 2017 |
| a | 17.9561 ± 0.0001 Å |
| b | 17.9561 ± 0.0001 Å |
| c | 14.8394 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4784.54 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0255 |
| Residual factor for significantly intense reflections | 0.0219 |
| Weighted residual factors for significantly intense reflections | 0.0487 |
| Weighted residual factors for all reflections included in the refinement | 0.0499 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 203025 (current) | 2017-11-10 | cif/ Adding structures of 7044726, 7044727 via cif-deposit CGI script. |
7044726.cif |
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