Information card for entry 7116924

Structure parameters

• Formula: C45 H40 Ag0 Cl7 F0 N5 O11 P0 Sb U Zn0
• Calculated formula: C44.99 H40 Cl7 N5 O11 Sb U
• Title of publication: Near-infrared-induced electron transfer of an uranyl macrocyclic complex without energy transfer to dioxygen
• Authors of publication: Christina M. Davis; Kei Ohkubo; I-Ting Ho; Zhan Zhang; Masatoshi Ishida; Yuanyuan Fang; Vincent M. Lynch; Karl M. Kadish; Jonathan L. Sessler; Shunichi Fukuzumi
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 6757
• a: 10.3488 ± 0.0005 Å
• b: 15.1997 ± 0.0007 Å
• c: 16.7191 ± 0.0006 Å
• α: 89.696 ± 0.002°
• β: 77.054 ± 0.002°
• γ: 84.978 ± 0.002°
• Cell volume: 2552.93 ± 0.19 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 11
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0779
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No