Information card for entry 7111211

Structure parameters

• Formula: C168 H196 Cl12 N48 O2 Pd6
• Calculated formula: C168 H192 Cl12 N48 O2 Pd6
• Title of publication: Assembly of supermolecular complexes from the tripodal ligand titmb: assembly of a large M6L8 cage from 14 components
• Authors of publication: Liu, Hong-Ke; Tong, Xiaojun
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 12
• Pages of publication: 1316
• a: 32.522 ± 0.011 Å
• b: 36.623 ± 0.012 Å
• c: 22.607 ± 0.008 Å
• α: 90°
• β: 98.049 ± 0.006°
• γ: 90°
• Cell volume: 26661 ± 16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2273
• Residual factor for significantly intense reflections: 0.0976
• Weighted residual factors for significantly intense reflections: 0.2708
• Weighted residual factors for all reflections included in the refinement: 0.3381
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No