Information card for entry 7063259

Structure parameters

• Formula: C61.8 H79.6 Au4 B20 Cl7.6 P4
• Calculated formula: C61 H78 Au4 B20 Cl6 P4
• Title of publication: Dinuclear gold(I) complexes with pyrimidine- and m-carborane-based bisphosphine ligands: synthesis, structure, photoluminescence and cytotoxicity against malignant pleural mesothelioma
• Authors of publication: Bardina, Elena E.; Matnurov, Egor M.; Bakaev, Ivan V.; Rakhmanova, Marianna I.; Davydova, Maria; Artem'ev, Alexander; Babak, Maria V.; Gushchin, Artem
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• a: 32.1688 ± 0.001 Å
• b: 13.7076 ± 0.0004 Å
• c: 18.0035 ± 0.0006 Å
• α: 90°
• β: 102.182 ± 0.001°
• γ: 90°
• Cell volume: 7760 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0431
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0726
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No