Information card for entry 7111466

Structure parameters

• Formula: C12 H16 Au2 N8
• Calculated formula: C12 H16 Au2 N8
• SMILES: C1C[NH+]=C(CCC2=[NH+]CCN2)N1.C(#N)[Au](C#N).[Au](C#N)C#N
• Title of publication: Molecular tectonics: design of luminescent H-bonded molecular networks
• Authors of publication: Paraschiv, Carmen; Ferlay, Sylvie; Hosseini, Mir Wais; Bulach, V�ronique; Planeix, Jean-Marc
• Journal of publication: Chemical Communications
• Year of publication: 2004
• Journal issue: 20
• Pages of publication: 2270 - 2271
• a: 20.4496 ± 0.0013 Å
• b: 6.5736 ± 0.0004 Å
• c: 13.0371 ± 0.0007 Å
• α: 90°
• β: 109.79 ± 0.005°
• γ: 90°
• Cell volume: 1649.04 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0256
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No