Information card for entry 4084601

Structure parameters

• Formula: C29 H33 Br N4 Pt
• Calculated formula: C29 H33 Br N4 Pt
• SMILES: [Pt]1(Br)([n]2ccccc2c2[n]1nc(c1c2CCCCCC1)c1ncccc1)(C)(C)Cc1ccccc1
• Title of publication: The Platinum Center is a Stronger Nucleophile than the Free Nitrogen Donors in a Dimethylplatinum Complex with a Dipyridylpyridazine Ligand
• Authors of publication: McCready, Matthew S.; Puddephatt, Richard J.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2261
• a: 8.8073 ± 0.0003 Å
• b: 18.8399 ± 0.0005 Å
• c: 15.8807 ± 0.0004 Å
• α: 90°
• β: 90.543 ± 0.002°
• γ: 90°
• Cell volume: 2634.94 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0506
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0658
• Weighted residual factors for all reflections included in the refinement: 0.0701
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No