Information card for entry 4514305

Structure parameters

• Formula: C6 H18 Au Br N3 P
• Calculated formula: C6 H18 Au Br N3 P
• SMILES: CN([P](N(C)C)([Au]Br)N(C)C)C
• Title of publication: Halide Effects on the Sublimation Temperature of X-Au-L Complexes: Implications for Their Use as Precursors in Vapor Phase Deposition Methods.
• Authors of publication: Carden, Will G.; Pedziwiatr, Jakub; Abboud, Khalil A.; McElwee-White, Lisa
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2017
• Journal volume: 9
• Journal issue: 46
• Pages of publication: 40998 - 41005
• a: 14.8743 ± 0.0005 Å
• b: 11.3479 ± 0.0004 Å
• c: 7.2893 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1230.38 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0157
• Residual factor for significantly intense reflections: 0.0119
• Weighted residual factors for significantly intense reflections: 0.0259
• Weighted residual factors for all reflections included in the refinement: 0.0264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No