Information card for entry 7012875

Structure parameters

• Formula: C30 H42 Cu F12 N7 O2.2 P2
• Calculated formula: C30 H36.5 Cu F12 N7 O2.2 P2
• Title of publication: The preparation and characterisation of cyclam/anthraquinone macrocyle/intercalator complexes and their interactions with DNAElectronic supplementary information (ESI) available: Figs. S1?8; gel electrophoresis patterns, 1H NMR spectra, and overlap interactions between the macrocycle and DNA. See http://www.rsc.org/suppdata/dt/b3/b302123h/
• Authors of publication: Ellis, Leanne T.; Perkins, David F.; Turner, Peter; Hambley, Trevor W.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 13
• Pages of publication: 2728
• a: 8.304 ± 0.002 Å
• b: 9.899 ± 0.003 Å
• c: 22.647 ± 0.006 Å
• α: 95.644 ± 0.005°
• β: 95.614 ± 0.004°
• γ: 105.8 ± 0.004°
• Cell volume: 1767.4 ± 0.8 ų
• Cell temperature: 273.2 K
• Ambient diffraction temperature: 273.2 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: 0.0728
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for all reflections: 0.0381
• Weighted residual factors for all reflections included in the refinement: 0.0371
• Goodness-of-fit parameter for all reflections: 2.791
• Goodness-of-fit parameter for all reflections included in the refinement: 3.245
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No