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Information card for entry 4336392
Preview
Coordinates | 4336392.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H15 N3 Pt |
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Calculated formula | C22 H15 N3 Pt |
SMILES | [Pt]12([n]3c(c4c2cccc4)cccc3n2[n]1ccc2)C#Cc1ccccc1 |
Title of publication | Synthesis, Structure, Photophysics, and a DFT Study of Phosphorescent C*N^N- and C^N^N-Coordinated Platinum Complexes |
Authors of publication | Caleb F. Harris; Dileep A. K. Vezzu; Libero Bartolotti; Paul D. Boyle; Shouquan Huo |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Pages of publication | 11711 - 11722 |
a | 10.6293 ± 0.0016 Å |
b | 11.838 ± 0.002 Å |
c | 14.037 ± 0.002 Å |
α | 80.17 ± 0.013° |
β | 82.194 ± 0.004° |
γ | 89.536 ± 0.005° |
Cell volume | 1724 ± 0.5 Å3 |
Cell temperature | 110 K |
Ambient diffraction temperature | 110 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 | 0.1078 |
Residual factor for significantly intense reflections | 0.0559 |
Weighted residual factors for significantly intense reflections | 0.1251 |
Weighted residual factors for all reflections included in the refinement | 0.1676 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
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/4336392.html
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