Information card for entry 4071817

Structure parameters

• Formula: C68 H66 Cu2 N8 O4 Pt2
• Calculated formula: C68 H66 Cu2 N8 O4 Pt2
• SMILES: [Pt]123([N](=C(c4n2[n]2[Cu]56([Cu]71([Pt]1([N](=C(c8n1[n]5c(C(=[N]6c1ccc(OC)cc1)C)c8C)C)c1ccc(OC)cc1)([C]17=CC=CC=C1)c1ccccc1)[C]13=CC=CC=C1)[N](=C(c2c4C)C)c1ccc(OC)cc1)C)c1ccc(OC)cc1)c1ccccc1
• 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: 11.3102 ± 0.0012 Å
• b: 16.5428 ± 0.0013 Å
• c: 18.7782 ± 0.0013 Å
• α: 112.169 ± 0.011°
• β: 95.433 ± 0.01°
• γ: 108.142 ± 0.011°
• Cell volume: 3000.8 ± 0.6 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0724
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1365
• Weighted residual factors for all reflections included in the refinement: 0.1495
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No