Information card for entry 7005170

Structure parameters

• Formula: C14 H28 Au2 N6 S2
• Calculated formula: C14 H28 Au2 N6 S2
• SMILES: [Au](=C(N(CC)CC)NC)SC#N
• Title of publication: Gold(I)-isocyanide and gold(I)-carbene complexes as substrates for the laser decoration of gold onto ceramic surfaces.
• Authors of publication: Heathcote, Robert; Howell, James A. S.; Jennings, Nicola; Cartlidge, David; Cobden, Lisa; Coles, Simon; Hursthouse, Michael
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 13
• Pages of publication: 1309 - 1315
• a: 7.1104 ± 0.0006 Å
• b: 7.5366 ± 0.0006 Å
• c: 19.7004 ± 0.0015 Å
• α: 90°
• β: 96.569 ± 0.005°
• γ: 90°
• Cell volume: 1048.78 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0702
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No