Information card for entry 4313614

Structure parameters

• Common name: (i-PrNC)AuCN*0.5CH2CL2
• Formula: C5.5 H8 Au Cl N2
• Calculated formula: C7.75 H10.5 Au1.5 Cl0.5 N3
• Title of publication: New Structural Motifs in the Aggregation of Neutral Gold(I) Complexes: Structures and Luminescence from (Alkyl isocyanide)AuCN
• Authors of publication: Rochelle L. White-Morris; Matthias Stender; Dino S. Tinti; Alan L. Balch; Daniel Rios; Saeed Attar
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3237 - 3244
• a: 10.9649 ± 0.0006 Å
• b: 12.3442 ± 0.0007 Å
• c: 16.9844 ± 0.001 Å
• α: 90°
• β: 95.405 ± 0.001°
• γ: 90°
• Cell volume: 2288.7 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No