Information card for entry 4115168

Structure parameters

• Chemical name: Phil Gale
• Formula: C124 H180 Cl8 N16 O8
• Calculated formula: C124 H180 Cl8 N16 O8
• Title of publication: Anion-Anion Assembly: A New Class of Anionic Supramolecular Polymer Containing 3,4-Dichloro-2,5-diamido-substituted Pyrrole Anion Dimers
• Authors of publication: Philip A. Gale; Korakot Navakhun; Salvatore Camiolo; Mark E. Light; Michael B. Hursthouse
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 11228 - 11229
• a: 16.472 ± 0.005 Å
• b: 18.028 ± 0.005 Å
• c: 24.398 ± 0.005 Å
• α: 69.036 ± 0.005°
• β: 76.52 ± 0.005°
• γ: 73.183 ± 0.005°
• Cell volume: 6408 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2051
• Residual factor for significantly intense reflections: 0.1107
• Weighted residual factors for significantly intense reflections: 0.2954
• Weighted residual factors for all reflections included in the refinement: 0.3389
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No