Information card for entry 4340227

Structure parameters

• Formula: C4 H7 N4 O3 Pt0.5
• Calculated formula: C4 H7 N4 O3 Pt0.5
• 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: 7.8601 ± 0.0016 Å
• b: 11.126 ± 0.002 Å
• c: 8.9545 ± 0.0018 Å
• α: 90°
• β: 103.41 ± 0.03°
• γ: 90°
• Cell volume: 761.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction 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 all reflections: 0.0395
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections included in the refinement: 0.0397
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No