Information card for entry 4120768

Structure parameters

• Formula: C164 H146 F24 N14 O8 P12 Re4
• Calculated formula: C163.987 H128 F24.04 N13.9867 O8 P12.0067 Re4
• Title of publication: Ring-Shaped Re(I) Multinuclear Complexes with Unique Photofunctional Properties
• Authors of publication: Tatsuki Morimoto; Chiaki Nishiura; Marina Tanaka; Jana Rohacova; Yuki Nakagawa; Yusuke Funada; Kazuhide Koike; Youhei Yamamoto; Sayaka Shishido; Tatsuhiro Kojima; Takuro Saeki; Tomoji Ozeki; Osamu Ishitani
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 13266 - 13269
• a: 46.6523 ± 0.0001 Å
• b: 46.6523 ± 0.0001 Å
• c: 46.6523 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 101536 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 219
• Hermann-Mauguin space group symbol: F -4 3 c
• Hall space group symbol: F -4a 2 3
• Residual factor for all reflections: 0.0207
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.689 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No