Information card for entry 4307382

Structure parameters

• Formula: C24 H36 Cl2 N8 Pt
• Calculated formula: C24 H36 Cl2 N8 Pt
• SMILES: C(NC(N(C)C)N(C)C)(c1ccccc1)=[NH][Pt]([NH]=C(NC(N(C)C)N(C)C)c1ccccc1)(Cl)Cl
• Title of publication: PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines
• Authors of publication: Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 1684 - 1693
• a: 10.4573 ± 0.0008 Å
• b: 11.2403 ± 0.0012 Å
• c: 12.2694 ± 0.0008 Å
• α: 90°
• β: 112.07 ± 0.007°
• γ: 90°
• Cell volume: 1336.5 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0454
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.0571
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No