Information card for entry 8105773

Structure parameters

• Formula: C20 H24 Cl2 N4 Pt
• Calculated formula: C20 H24 Cl2 N4 Pt
• SMILES: [Pt]12([n]3c(c4[n]1cccc4)cccc3)[NH](CCC[NH2]2)Cc1ccccc1.[Cl-].[Cl-]
• Title of publication: Crystal structure of (N-benzylpropane-1,3-diamine-κ 2 N, N′)(2,2′-bipyridine-κ 2 N,N′)platinum(II) chloride, C20H24Cl2N4Pt
• Authors of publication: Kiwada, Tatsuto; Katakasu, Hiromu; Odani, Akira
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 3
• Pages of publication: 539 - 541
• a: 13.1119 ± 0.0007 Å
• b: 13.5673 ± 0.0008 Å
• c: 11.7167 ± 0.0005 Å
• α: 90°
• β: 99.714 ± 0.007°
• γ: 90°
• Cell volume: 2054.44 ± 0.19 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 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: 0.0316
• Residual factor for significantly intense reflections: 0.0233
• Weighted residual factors for significantly intense reflections: 0.0497
• Weighted residual factors for all reflections included in the refinement: 0.0516
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No