Information card for entry 4303485

Structure parameters

• Formula: C9 H19 Cu N10 O7.5
• Calculated formula: C9 H18 Cu N10 O7.5
• Title of publication: Probing Metal-Ion Purine Interactions at DNA Minor-Groove Sites
• Authors of publication: Miguel A. Galindo; David Amantia; Alberto Martinez Martinez; William Clegg; Ross W. Harrington; Virtudes Moreno Martinez; Andrew Houlton
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10295 - 10303
• a: 8.725 ± 0.0005 Å
• b: 10.436 ± 0.0006 Å
• c: 11.2345 ± 0.0006 Å
• α: 115.481 ± 0.002°
• β: 108.755 ± 0.002°
• γ: 95.182 ± 0.002°
• Cell volume: 842.55 ± 0.09 ų
• Cell temperature: 423 ± 2 K
• Ambient diffraction temperature: 423 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No