Information card for entry 7213017

Structure parameters

• Formula: C18 H24 Cl2 N3 O4
• Calculated formula: C18 H24 Cl2 N3 O4
• Title of publication: CT complexes based on TEMPO radicals
• Authors of publication: Nakatsuji, Shin'ichi; Takai, Atsushi; Nishikawa, Kazuyoshi; Morimoto, Yukio; Yasuoka, Noritake; Suzuki, Kazuya; Enoki, Toshiaki; Anzai, Hiroyuki
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 1999
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 1747
• a: 12.47 ± 0.004 Å
• b: 17.279 ± 0.002 Å
• c: 9.599 ± 0.003 Å
• α: 90°
• β: 101.17 ± 0.03°
• γ: 90°
• Cell volume: 2029.1 ± 1 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.0769
• Goodness-of-fit parameter for significantly intense reflections: 1.17
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No