Information card for entry 7005102

Structure parameters

• Formula: C72 H129 Br Cl5 N8 O20.5 Zn
• Calculated formula: C72 H129 Br Cl5 N8 O20.5 Zn
• Title of publication: Cleavage of double-strand DNA by zinc complexes of dicationic 2,2'-dipyridyl derivatives.
• Authors of publication: An, Yan; Lin, Yan-Yong; Wang, Hui; Sun, Hong-Zhe; Tong, Ming-Liang; Ji, Liang-Nian; Mao, Zong-Wan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 12
• Pages of publication: 1250 - 1254
• a: 17.34 ± 0.003 Å
• b: 37.132 ± 0.006 Å
• c: 13.715 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8831 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0734
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.1652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No