Information card for entry 2311602

Structure parameters

• Chemical name: trans-diiodobis(1,3,5-triaza-7-phosphaadamantane)platinum(II)
• Formula: C12 H24 I2 N6 P2 Pt
• Calculated formula: C12 H24 I2 N6 P2 Pt
• SMILES: [P]12(CN3CN(CN(C3)C2)C1)[Pt](I)(I)[P]12CN3CN(CN(C3)C2)C1
• Title of publication: trans-Diiodobis(1,3,5-triaza-7-phosphaadamantane)platinum(II).
• Authors of publication: Otto, S.; Roodt, A.
• Journal of publication: Acta crystallographica. Section C, Crystal structure communications
• Year of publication: 2001
• Journal volume: 57
• Journal issue: Pt 5
• Pages of publication: 540 - 541
• a: 7.472 ± 0.002 Å
• b: 12.141 ± 0.004 Å
• c: 10.537 ± 0.003 Å
• α: 90°
• β: 95.348 ± 0.005°
• γ: 90°
• Cell volume: 951.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0272
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No