Information card for entry 7720171

Structure parameters

• Formula: C40 H44 Cu N3 O
• Calculated formula: C40 H44 Cu N3 O
• Title of publication: Luminescent N-heterocyclic carbene Cu(I) complexes with N^O chelating ligands exhibit microsecond lifetimes and photocatalytic activity.
• Authors of publication: Chakraborty, Soumi; Mao, Erqian; Gray, Thomas G.; Teets, Thomas S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 7
• Pages of publication: 2908 - 2918
• a: 10.437 ± 0.003 Å
• b: 15.572 ± 0.005 Å
• c: 21.915 ± 0.007 Å
• α: 90°
• β: 102.75 ± 0.004°
• γ: 90°
• Cell volume: 3473.9 ± 1.9 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0987
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No