Information card for entry 7717679

Structure parameters

• Formula: C28 H40 B2 Br In N8
• Calculated formula: C28 H40 B2 Br In N8
• Title of publication: Ring-opening polymerization of ε-caprolactone with a macrocyclic tetracarbene indium complex.
• Authors of publication: Brothers, Henry R.; Chambenahalli, Raju; Nichol, Gary S.; Garden, Jennifer A.; Jenkins, David M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 487 - 491
• a: 18.1187 ± 0.0005 Å
• b: 18.2532 ± 0.0005 Å
• c: 19.0483 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6299.7 ± 0.3 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 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: 0.1048
• Residual factor for significantly intense reflections: 0.0858
• Weighted residual factors for significantly intense reflections: 0.218
• Weighted residual factors for all reflections included in the refinement: 0.2362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No