Information card for entry 7020626

Structure parameters

• Formula: C18 H26 Cl2 N4 O2 Pt
• Calculated formula: C18 H26 Cl2 N4 O2 Pt
• SMILES: [Pt]12([n]3cccc4c3c3[n]1cccc3cc4)[NH2][C@@H]1[C@@H]([NH2]2)CCCC1.[Cl-].[Cl-].O.O
• Title of publication: Cytotoxic platinum(II) intercalators that incorporate 1R,2R-diaminocyclopentane.
• Authors of publication: Garbutcheon-Singh, K Benjamin; Leverett, Peter; Myers, Simon; Aldrich-Wright, Janice R
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 4
• Pages of publication: 918 - 926
• a: 11.5777 ± 0.0006 Å
• b: 7.0009 ± 0.0004 Å
• c: 12.5079 ± 0.0007 Å
• α: 90°
• β: 93.125 ± 0.001°
• γ: 90°
• Cell volume: 1012.31 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0159
• Residual factor for significantly intense reflections: 0.0154
• Weighted residual factors for significantly intense reflections: 0.0385
• Weighted residual factors for all reflections included in the refinement: 0.0387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No