Information card for entry 7007232

Structure parameters

• Common name: [Pt{NH=C(Ph)NC(Ph)=NPh}2].2CH2Cl2
• Formula: C42 H36 Cl4 N6 Pt
• Calculated formula: C42 H36 Cl4 N6 Pt
• SMILES: c1ccccc1C1=NC(=[N]([Pt]2(N1)NC(=NC(=[N]2c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.C(Cl)Cl.C(Cl)Cl
• Title of publication: A new family of luminescent compounds: platinum(II) imidoylamidinates exhibiting pH-dependent room temperature luminescence.
• Authors of publication: Sarova, Ginka H.; Bokach, Nadezhda A.; Fedorov, Alexander A.; Berberan-Santos, Mário N; Kukushkin, Vadim Yu; Haukka, Matti; Fraústo da Silva, João J R; Pombeiro, Armando J. L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 31
• Pages of publication: 3798 - 3805
• a: 15.6529 ± 0.0009 Å
• b: 6.0112 ± 0.0002 Å
• c: 22.0709 ± 0.0012 Å
• α: 90°
• β: 110.086 ± 0.002°
• γ: 90°
• Cell volume: 1950.4 ± 0.17 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: 0.0593
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0794
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No