Information card for entry 1507066

Structure parameters

• Formula: C46.5 H69 Cl3 N6 O14.5 Zn3
• Calculated formula: C46.5 H69 Cl3.005 N6 O14.5 Zn3
• Title of publication: Direct observation of enantioselective synergism at trimetallic centers.
• Authors of publication: Gao, Jian; Zingaro, Ralph A.; Reibenspies, Joseph H.; Martell, Arthur E.
• Journal of publication: Organic letters
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 14
• Pages of publication: 2453 - 2455
• a: 15.5481 ± 0.0017 Å
• b: 26.735 ± 0.003 Å
• c: 27.74 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11531 ± 2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.1586
• Residual factor for significantly intense reflections: 0.0857
• Weighted residual factors for significantly intense reflections: 0.1911
• Weighted residual factors for all reflections included in the refinement: 0.2239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No