Information card for entry 4107700

Structure parameters

• Chemical name: FeC60C6H4COOH5_THF
• Formula: C280 H100 Fe2 O20
• Calculated formula: C245 H132 Fe2 O32
• Title of publication: Photocurrent-Generating Properties of Organometallic Fullerene Molecules on an Electrode
• Authors of publication: Yutaka Matsuo; Katsuhiko Kanaizuka; Keiko Matsuo; Yu-Wu Zhong; Takahiro Nakae; Eiichi Nakamura
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 5016 - 5017
• a: 19.114 ± 0.005 Å
• b: 20.233 ± 0.005 Å
• c: 25.671 ± 0.005 Å
• α: 109.406 ± 0.005°
• β: 99.042 ± 0.005°
• γ: 92.413 ± 0.005°
• Cell volume: 9200 ± 4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2116
• Residual factor for significantly intense reflections: 0.1276
• Weighted residual factors for significantly intense reflections: 0.343
• Weighted residual factors for all reflections included in the refinement: 0.413
• Goodness-of-fit parameter for all reflections included in the refinement: 1.264
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No