Information card for entry 7203690

Structure parameters

• Formula: C22 H32 N4 O4
• Calculated formula: C22 H24 N4 O4
• Title of publication: Intramolecular exchange interactions in non-aromatic bis-nitronyl-nitroxides
• Authors of publication: Christophe Stroh; Raymond Ziessel; Gabriele Raudaschl-Sieber; Frank H. Köhler; Philippe Turek
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2005
• Journal volume: 15
• Journal issue: 8
• Pages of publication: 850
• a: 10.319 ± 0.0006 Å
• b: 9.7704 ± 0.0008 Å
• c: 12.362 ± 0.0008 Å
• α: 90°
• β: 113.394 ± 0.006°
• γ: 90°
• Cell volume: 1143.89 ± 0.15 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.112
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for all reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections: 1.573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No