Information card for entry 4071815

Structure parameters

• Formula: C36 H37 K N4 Pt
• Calculated formula: C36 H37 K N4 Pt
• SMILES: [Pt]1(n2nc(C(=N\c3c(cccc3C)C)\C)c(c2C(=[N]1c1c(cccc1C)C)C)C)(c1ccccc1)c1ccccc1.[K+]
• Title of publication: Mononuclear Organometallic Platinum(II) Complexes and Platinum(II)−Copper(I) Mixed Complexes from Symmetrical 3,5-Bis(iminoacetyl)pyrazolate Ligands
• Authors of publication: Moret, Marc-Etienne; Chen, Peter
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 19
• Pages of publication: 4903
• a: 12.5793 ± 0.0012 Å
• b: 9.2999 ± 0.0011 Å
• c: 28.4841 ± 0.0015 Å
• α: 90°
• β: 92.192 ± 0.011°
• γ: 90°
• Cell volume: 3329.8 ± 0.5 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 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: 0.0537
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No