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Information card for entry 4133660
Preview
Coordinates | 4133660.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | naphthalene_nPrNH2_MTAD |
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Formula | C16 H21.31 N4 O2.66 |
Calculated formula | C16 H21.314 N4 O2.657 |
Title of publication | Palladium-Catalyzed Dearomative syn-1,4-Diamination. |
Authors of publication | Wertjes, William C.; Okumura, Mikiko; Sarlah, David |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2019 |
Journal volume | 141 |
Journal issue | 1 |
Pages of publication | 163 - 167 |
a | 9.8206 ± 0.0004 Å |
b | 11.1581 ± 0.0005 Å |
c | 15.3236 ± 0.0007 Å |
α | 101.924 ± 0.001° |
β | 100.739 ± 0.001° |
γ | 100.154 ± 0.001° |
Cell volume | 1573.33 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100.01 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0799 |
Residual factor for significantly intense reflections | 0.0551 |
Weighted residual factors for significantly intense reflections | 0.1248 |
Weighted residual factors for all reflections included in the refinement | 0.1376 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4133660.html
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