Information card for entry 4030220

Structure parameters

• Chemical name: compound 13
• Formula: C74.5 H65 O8.25
• Calculated formula: C74.5 H65 O8.25
• Title of publication: Synthesis of eight-arm, branched oligonucleotide hybrids and studies on the limits of DNA-driven assembly.
• Authors of publication: Schwenger, Alexander; Gerlach, Claudia; Griesser, Helmut; Richert, Clemens
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 79
• Journal issue: 23
• Pages of publication: 11558 - 11566
• a: 18.6028 ± 0.0008 Å
• b: 19.681 ± 0.0009 Å
• c: 19.8332 ± 0.0008 Å
• α: 114.23 ± 0.002°
• β: 101.248 ± 0.002°
• γ: 94.91 ± 0.002°
• Cell volume: 6382.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1014
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for significantly intense reflections: 0.2096
• Weighted residual factors for all reflections included in the refinement: 0.2204
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No