Information card for entry 4112454

Structure parameters

• Formula: C40 H44 Cl6 N6 O12 Rh2 S2
• Calculated formula: C40 H44 Cl6 N6 O12 Rh2 S2
• SMILES: C1(=[O][Rh]234([n]5cn(cc5)S(=O)(=O)c5cccc6c5cccc6N(C)C)[O]=C(C)O[Rh]4([n]4cn(cc4)S(=O)(=O)c4cccc5c4cccc5N(C)C)([O]=C(O2)C)([O]=C(O3)C)O1)C.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl
• Title of publication: Dirhodium Tetracarboxylate Scaffolds as Reversible Fluorescence-Based Nitric Oxide Sensors
• Authors of publication: Scott A. Hilderbrand; Mi Hee Lim; Stephen J. Lippard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 4972 - 4978
• a: 8.577 ± 0.002 Å
• b: 9.026 ± 0.002 Å
• c: 16.026 ± 0.004 Å
• α: 94.218 ± 0.005°
• β: 96.824 ± 0.004°
• γ: 96.319 ± 0.005°
• Cell volume: 1219.7 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.1215
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No