Information card for entry 4103802

Structure parameters

• Formula: C30 H56 F9 N8 O13 S3 Tb
• Calculated formula: C30 H56 F9 N8 O13 S3 Tb
• Title of publication: New Macrocyclic Terbium(III) Complex for Use in RNA Footprinting Experiments
• Authors of publication: Matthew J. Belousoff; Phuc Ung; Craig M. Forsyth; Yitzhak Tor; Leone Spiccia; Bim Graham
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 1106 - 1114
• a: 11.6554 ± 0.0004 Å
• b: 13.5597 ± 0.0005 Å
• c: 15.5642 ± 0.0005 Å
• α: 103.382 ± 0.002°
• β: 97.274 ± 0.002°
• γ: 95.948 ± 0.002°
• Cell volume: 2351.15 ± 0.14 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0224
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0497
• Weighted residual factors for all reflections included in the refinement: 0.0506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No