Information card for entry 7705305

Structure parameters

• Formula: C15 H28 Cl2 N2 O
• Calculated formula: C15 H28 Cl2 N2 O
• SMILES: [Cl-].[Cl-].OC.[NH3+][C@]12[C@@]3([NH3+])[C@@H]4[C@H]5[C@H]([C@@H]1C[C@@H](C3)C5)C[C@H](C2)C4
• Title of publication: Synthesis and antiproliferative activity of hindered, chiral 1,2-diaminodiamantane platinum(II) complexes.
• Authors of publication: Bakhonsky, Vladyslav V.; Pashenko, Aleksander A.; Becker, Jonathan; Hausmann, Heike; De Groot, Huub J. M.; Overkleeft, Herman S.; Fokin, Andrey A.; Schreiner, Peter R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 40
• Pages of publication: 14009 - 14016
• a: 9.7449 ± 0.0003 Å
• b: 8.4127 ± 0.0003 Å
• c: 9.7717 ± 0.0003 Å
• α: 90°
• β: 92.4679 ± 0.0015°
• γ: 90°
• Cell volume: 800.35 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0207
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0511
• Weighted residual factors for all reflections included in the refinement: 0.0516
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No