Information card for entry 7028337

Structure parameters

• Formula: C40 H46 N6 O4
• Calculated formula: C40 H46 N6 O4
• Title of publication: Quinoline-attached triazacyclononane (TACN) derivatives as fluorescent zinc sensors.
• Authors of publication: Mikata, Yuji; Nodomi, Yuki; Kizu, Asako; Konno, Hideo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1684 - 1690
• a: 10.257 ± 0.0018 Å
• b: 13.83 ± 0.003 Å
• c: 13.985 ± 0.003 Å
• α: 68.153 ± 0.007°
• β: 71.191 ± 0.007°
• γ: 80.492 ± 0.009°
• Cell volume: 1740.7 ± 0.6 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections included in the refinement: 0.2269
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No