Information card for entry 4101404

Structure parameters

• Formula: C34 H32 B2 Cu F8 N4 O4
• Calculated formula: C34 H28 B2 Cu F8 N4 O4
• Title of publication: Direct nitric oxide detection in aqueous solution by copper(II) fluorescein complexes.
• Authors of publication: Lim, Mi Hee; Wong, Brian A; Pitcock, Jr, William H; Mokshagundam, Deepa; Baik, Mu-Hyun; Lippard, Stephen J
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 44
• Pages of publication: 14364 - 14373
• a: 8.1902 ± 0.0008 Å
• b: 11.6112 ± 0.0011 Å
• c: 18.2776 ± 0.0018 Å
• α: 90°
• β: 95.235 ± 0.002°
• γ: 90°
• Cell volume: 1730.9 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1276
• Weighted residual factors for all reflections included in the refinement: 0.1355
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No