Information card for entry 4340225

Structure parameters

• Formula: C8 H14 N8 O6 Pt
• Calculated formula: C8 H14 N8 O6 Pt
• SMILES: [Pt]([NH3])([NH3])([n]1ccncc1)[n]1ccncc1.N(=O)(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Pyrazine as a building block for molecular architectures with PtII.
• Authors of publication: Willermann, Michael; Mulcahy, Clodagh; Sigel, Roland K. O.; Cerdà, Marta Morell; Freisinger, Eva; Sanz Miguel, Pablo J.; Roitzsch, Michael; Lippert, Bernhard
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 2093 - 2099
• a: 5.81 ± 0.0012 Å
• b: 15.87 ± 0.003 Å
• c: 16.473 ± 0.003 Å
• α: 90°
• β: 95.61 ± 0.03°
• γ: 90°
• Cell volume: 1511.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections included in the refinement: 0.0975
• Goodness-of-fit parameter for all reflections included in the refinement: 0.928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No