Information card for entry 7250488

Structure parameters

• Formula: C23 H25 Br2 Cl N8 O2
• Calculated formula: C23 H21 Br2 Cl N8 O2
• Title of publication: Gold(i) and gold(iii) complexes of triazolyl-functionalised NHCs
• Authors of publication: Al-Buthabhak, Hawraa S.; Al-Ameed, Karrar; Yu, Yu; Sobolev, Alexandre N.; Moggach, Stephen A.; Al-Salami, Hani; Ferro, Vito; Baker, Murray V.
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 23
• Pages of publication: 18123 - 18141
• a: 4.4671 ± 0.0002 Å
• b: 14.8151 ± 0.0008 Å
• c: 39.6576 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2624.6 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1195
• Residual factor for significantly intense reflections: 0.106
• Weighted residual factors for significantly intense reflections: 0.2976
• Weighted residual factors for all reflections included in the refinement: 0.308
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No