Information card for entry 7017950

Structure parameters

• Formula: C2 H2 Au Cl2 K N2 O
• Calculated formula: C2 H2 Au Cl2 K N2 O
• SMILES: C(#N)[Au](Cl)(C#N)Cl.[K+].O
• Title of publication: Structural organization and dimensionality at the hands of weak intermolecular Au···Au, Au···X and X···X (X = Cl, Br, I) interactions.
• Authors of publication: Ovens, Jeffrey S.; Truong, Kimberley N.; Leznoff, Daniel B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 4
• Pages of publication: 1345 - 1351
• a: 17.345 ± 0.01 Å
• b: 7.712 ± 0.004 Å
• c: 6.126 ± 0.003 Å
• α: 90°
• β: 101.399 ± 0.006°
• γ: 90°
• Cell volume: 803.3 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0304
• Residual factor for significantly intense reflections: 0.0193
• Weighted residual factors for all reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.027
• Weighted residual factors for all reflections included in the refinement: 0.0269
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9723
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No