Information card for entry 4332777

Structure parameters

• Chemical name: cis-bis(triphenylphosphine)-(cytosine,N3)-(cytosinato,N4) -platinum(II) nitrate water dimethylformamide solvated
• Formula: C49 H52 N8 O7 P2 Pt
• Calculated formula: C49 H52 N8 O7 P2 Pt
• SMILES: [Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([n]1c(=O)n(C)ccc1N)Nc1nc(=O)n(C)cc1.N(=O)(=O)[O-].N(C=O)(C)C.O
• Title of publication: Mono- and Polynuclear Complexes of the Model Nucleobase 1-Methylcytosine. Synthesis and Characterization ofcis-[(PMe2Ph)2Pt{(1-MeCy(−H)}]3(NO3)3andcis-[(PPh3)2Pt{1-MeCy(−H)}(1-MeCy)]NO3
• Authors of publication: Longato, Bruno; Montagner, Diego; Zangrando, Ennio
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 20
• Pages of publication: 8179 - 8187
• a: 13.19 ± 0.003 Å
• b: 38.648 ± 0.005 Å
• c: 9.754 ± 0.003 Å
• α: 90°
• β: 110.3 ± 0.02°
• γ: 90°
• Cell volume: 4663 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.031
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No