Information card for entry 7024271

Structure parameters

• Formula: C53.75 H43.75 Cl4 Cu3 N6.25 O11.25
• Calculated formula: C53.75 H38 Cl4 Cu3 N6.25 O11.25
• Title of publication: Copper inverse-9-metallacrown-3 compounds interacting with DNA.
• Authors of publication: Afrati, Tereza; Pantazaki, Anastasia A.; Dendrinou-Samara, Catherine; Raptopoulou, Catherine; Terzis, Aris; Kessissoglou, Dimitris P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 3
• Pages of publication: 765 - 775
• a: 14.82 ± 0.01 Å
• b: 15.783 ± 0.008 Å
• c: 24.9 ± 0.01 Å
• α: 90.61 ± 0.02°
• β: 94.51 ± 0.03°
• γ: 104.34 ± 0.03°
• Cell volume: 5623 ± 5 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0929
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1495
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No