Information card for entry 2234426

Structure parameters

• Chemical name: <i>cis</i>-(Di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)bis(thiocyanato- κ<i>S</i>)platinum(II)
• Formula: C12 H9 N5 Pt S2
• Calculated formula: C12 H9 N5 Pt S2
• SMILES: [Pt]1([n]2c(Nc3[n]1cccc3)cccc2)(SC#N)SC#N
• Title of publication: <i>cis</i>-(Di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)bis(thiocyanato-κ<i>S</i>)platinum(II)
• Authors of publication: Ha, Kwang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m440
• a: 7.2282 ± 0.0006 Å
• b: 9.8308 ± 0.0008 Å
• c: 10.2501 ± 0.0008 Å
• α: 94.292 ± 0.002°
• β: 93.081 ± 0.002°
• γ: 106.123 ± 0.002°
• Cell volume: 695.64 ± 0.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0706
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes