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Information card for entry 4082620
Preview
Coordinates | 4082620.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H29 Br2 N3 Pt S |
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Calculated formula | C27 H29 Br2 N3 Pt S |
SMILES | [Pt]1(Br)(Br)[S](CCN2C=1N(c1ccccc21)C(c1ccccc1)c1ccccc1)C(C)C.N#CC |
Title of publication | Platinum(II) Complexes with Thioether-Functionalized Benzimidazolin-2-ylidene Ligands: Synthesis, Structural Characterization, and Application in Hydroelementation Reactions |
Authors of publication | Bernhammer, Jan C.; Huynh, Han Vinh |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 1 |
Pages of publication | 172 |
a | 15.1236 ± 0.001 Å |
b | 11.4199 ± 0.0008 Å |
c | 16.7775 ± 0.0011 Å |
α | 90° |
β | 113.319 ± 0.001° |
γ | 90° |
Cell volume | 2660.9 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0504 |
Residual factor for significantly intense reflections | 0.0388 |
Weighted residual factors for significantly intense reflections | 0.0744 |
Weighted residual factors for all reflections included in the refinement | 0.0787 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.971 |
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/4082620.html
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