Information card for entry 7105737

Structure parameters

• Formula: C16.45 H16.675 Cl2 N2.225 Pd
• Calculated formula: C16.45 H16.675 Cl2 N2.225 Pd
• Title of publication: The first stereoselective syntheses of 2,2'-biindoline
• Authors of publication: Steven Wales; Anthony Willis; Paul Keller
• Journal of publication: Chem.Commun.
• Year of publication: 2010
• Journal volume: 46
• Pages of publication: 9226
• a: 21.0215 ± 0.0006 Å
• b: 8.29 ± 0.0002 Å
• c: 9.0928 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1584.59 ± 0.08 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0267
• Residual factor for significantly intense reflections: 0.0217
• Weighted residual factors for all reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.049
• Weighted residual factors for all reflections included in the refinement: 0.0507
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8545
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No