Information card for entry 7107399

Structure parameters

• Formula: C31 H34 N4 O Pt
• Calculated formula: C31 H34 N4 O Pt
• SMILES: c12c(cc(cc1C(C)(C)C)C(C)(C)C)N(c1ccccc1)[Pt]1([n]3c(N=[N]1c1ccccc1)cccc3)O2
• Title of publication: Donor-acceptor systems of Pt(II) and redox-induced reactivity towards small molecules
• Authors of publication: Naina Deibel; David Schweinfurth; Stephan Hohloch; Jan Fiedler; Biprajit Sarkar
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 2388
• a: 14.126 ± 0.0013 Å
• b: 9.7082 ± 0.0008 Å
• c: 21.2529 ± 0.0019 Å
• α: 90°
• β: 100.801 ± 0.004°
• γ: 90°
• Cell volume: 2862.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0559
• Weighted residual factors for all reflections included in the refinement: 0.0615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No