Information card for entry 4026438

Structure parameters

• Formula: C46 H46 Br4 N8 O8 Zn2
• Calculated formula: C46 H46 Br4 N8 O8 Zn2
• Title of publication: A Short Desymmetrization Protocol for the Coordination Environment in Bis-salphen Scaffolds
• Authors of publication: Eduardo C. Escudero-Adán; Marta Martínez Belmonte; Eddy Martin; Giovanni Salassa; Jordi Benet-Buchholz; Arjan W. Kleij
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2011
• Journal volume: 76
• Pages of publication: 5404 - 5412
• a: 8.7923 ± 0.0009 Å
• b: 20.225 ± 0.0022 Å
• c: 14.3873 ± 0.0014 Å
• α: 90°
• β: 106.642 ± 0.007°
• γ: 90°
• Cell volume: 2451.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0893
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.1103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No