Information card for entry 2018917

Structure parameters

• Chemical name: <i>cis</i>-amminedibromido(2-methylpyridine-κ<i>N</i>)platinum(II)
• Formula: C6 H10 Br2 N2 Pt
• Calculated formula: C6 H10 Br2 N2 Pt
• SMILES: c1[n]([Pt]([NH3])(Br)Br)c(ccc1)C
• Title of publication: A bromine analogue of picoplatin: a new substance from the group of platinum-based chemotherapeutics
• Authors of publication: Pažout, Richard; Maixner, Jaroslav; Hrdá, Michaela; Loužilová, Tereza; Kačer, Petr
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 4
• Pages of publication: 337 - 339
• a: 10.0371 ± 0.0003 Å
• b: 9.0733 ± 0.0003 Å
• c: 11.4901 ± 0.0004 Å
• α: 90°
• β: 102.12 ± 0.003°
• γ: 90°
• Cell volume: 1023.07 ± 0.06 ų
• Cell temperature: 190 K
• Ambient diffraction temperature: 190 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: 0.0366
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0347
• Weighted residual factors for all reflections included in the refinement: 0.0357
• Goodness-of-fit parameter for all reflections included in the refinement: 1.69
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes