Information card for entry 7023381

Structure parameters

• Formula: C17 H16 Cu3 N9
• Calculated formula: C17 H16 Cu3 N9
• Title of publication: Molecular tectonics: tuning the dimensionality and topology of extended cyanocuprate networks using a bisamidinium cation.
• Authors of publication: Ferlay, Sylvie; Dechambenoit, Pierre; Kyritsakas, Nathalie; Hosseini, Mir Wais
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 32
• Pages of publication: 11661 - 11671
• a: 10.7515 ± 0.0003 Å
• b: 12.6791 ± 0.0003 Å
• c: 13.7566 ± 0.0004 Å
• α: 90°
• β: 93.894 ± 0.002°
• γ: 90°
• Cell volume: 1870.96 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.043
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No