Information card for entry 4314081

Structure parameters

• Formula: C16 H12 Cl3 N5 Pt
• Calculated formula: C16 H12 Cl3 N5 Pt
• SMILES: [Pt]12(Cl)(Cl)(Cl)[n]3ccccc3N=[N]1c1ccccc1N2c1ncccc1
• Title of publication: Design and Synthesis of a New Binucleating Ligand via Cobalt-Promoted C-N Bond Fusion Reaction. Ligand Isolation and Its Coordination to Nickel, Palladium, and Platinum
• Authors of publication: Kunal K. Kamar; Srijit Das; Chen-Hsiung Hung; Alfonso Castiñeiras; Michael D. Kuz'min; Conrado Rillo; Juan Bartolomé; Sreebrata Goswami
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5367 - 5375
• a: 11.641 ± 0.003 Å
• b: 8.486 ± 0.002 Å
• c: 18.402 ± 0.005 Å
• α: 90°
• β: 105.817 ± 0.004°
• γ: 90°
• Cell volume: 1749 ± 0.8 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: 0.0334
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No