Information card for entry 7210513

Structure parameters

• Formula: C66 H116 Au2 N8
• Calculated formula: C66 H116 Au2 N8
• SMILES: C1(=[NH+]CC(CN1)(CCCCCCCCCCCC)CCCCCCCCCCCC)c1ccc(C2=[NH+]CC(CN2)(CCCCCCCCCCCC)CCCCCCCCCCCC)cc1.N#C[Au]C#N.N#C[Au]C#N
• Title of publication: Molecular tectonics: control of packing of luminescent networks formed upon combining bisamidinium tectons with dicyanometallates
• Authors of publication: Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 1922
• a: 8.417 ± 0.003 Å
• b: 10.601 ± 0.004 Å
• c: 38.544 ± 0.011 Å
• α: 90°
• β: 95.129 ± 0.011°
• γ: 90°
• Cell volume: 3425 ± 2 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.153
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.1001
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No