Information card for entry 1575307

Structure parameters

• Formula: C30 H28 Cu N10 O8
• Calculated formula: C30 H28 Cu N10 O8
• Title of publication: Developing highly active Cu(ii)-triazolyl-pyridine complexes for C–H functionalization of 9H-fluorene and indole via a borrowing hydrogen strategy
• Authors of publication: Shekhawat, Bhawana; Ahamed, Subuhan; Gahlaut, Puneet Singh; Ghosh, Saurav; Gautam, Deepak; Mondal, Kartik Chandra; Jana, Barun
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 20
• Pages of publication: 6001 - 6010
• a: 13.043 ± 0.0004 Å
• b: 12.8084 ± 0.0004 Å
• c: 9.2763 ± 0.0003 Å
• α: 90°
• β: 103.57 ± 0.001°
• γ: 90°
• Cell volume: 1506.44 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0441
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No