Information card for entry 7105079

Structure parameters

• Formula: C37 H28 Au2 Cl4 P2 S3
• Calculated formula: C37 H28 Au2 Cl4 P2 S3
• Title of publication: Conjugated ligand-based tribochromic luminescence
• Authors of publication: Angela M. Kuchison; Michael O. Wolf; Brian O. Patrick
• Journal of publication: Chem. Commun.
• Year of publication: 2009
• Pages of publication: 7387 - 7389
• a: 9.6976 ± 0.0002 Å
• b: 28.8439 ± 0.0006 Å
• c: 27.6767 ± 0.0006 Å
• α: 90°
• β: 97.371 ± 0.001°
• γ: 90°
• Cell volume: 7677.7 ± 0.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1264
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections: 0.1118
• Weighted residual factors for significantly intense reflections: 0.0669
• Weighted residual factors for all reflections included in the refinement: 0.0622
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1465
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No