Information card for entry 4075092

Structure parameters

• Formula: C12 H15 N3 Pt
• Calculated formula: C12 H15 N3 Pt
• SMILES: [Pt]1([n]2c(c3[n]1c(N)ccc3)cccc2)(C)C
• Title of publication: Protonation of Platinum(II) Dialkyl Complexes Containing Ligands with Proximate H-Bonding Substituents
• Authors of publication: Britovsek, George J. P.; Taylor, Russell A.; Sunley, Glenn J.; Law, David J.; White, Andrew J. P.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 8
• Pages of publication: 2074
• a: 16.8836 ± 0.0005 Å
• b: 7.7972 ± 0.0003 Å
• c: 17.912 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2358.02 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.279
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No