Information card for entry 4300020

Structure parameters

• Formula: C14 H23 Cl2 N9 O10 Pt
• Calculated formula: C14 H23 Cl2 N9 O10 Pt
• SMILES: [Pt]([NH2]C)([NH2]C)(n1c(=O)nccc1)[N]1C(=O)NC=CC=1.[nH+]1c(N)nccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: From Simple trans-[a2Pt(2-hydroxypyrimidine)2]2+ (a = NH3, CH3NH2) Complexes to Structures of Higher Complexity. Molecular Recognition of 2-Aminopyrimidine by Hydrogen Bond Formation and Reactivity toward Additional Metal Ions
• Authors of publication: Jorge A. R. Navarro; Eva Freisinger; Bernhard Lippert
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 1059 - 1065
• a: 8.355 ± 0.002 Å
• b: 11.221 ± 0.002 Å
• c: 13.004 ± 0.003 Å
• α: 86.76 ± 0.03°
• β: 78.62 ± 0.03°
• γ: 77.96 ± 0.03°
• Cell volume: 1168.7 ± 0.5 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0395
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for all reflections: 0.0943
• Weighted residual factors for significantly intense reflections: 0.08
• Goodness-of-fit parameter for all reflections: 1.013
• Goodness-of-fit parameter for significantly intense reflections: 1.065
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No