Information card for entry 7034530

Structure parameters

• Formula: C30 H39 N
• Calculated formula: C30 H39 N
• SMILES: N(Cc1c(cc(cc1C)C)C)(Cc1c(cc(cc1C)C)C)Cc1c(cc(cc1C)C)C
• Title of publication: Tris(8-methoxy-2-quinolylmethyl)amine (8-MeOTQA) as a highly fluorescent Zn(2+) probe prepared by convenient C3-symmetric tripodal amine synthesis.
• Authors of publication: Mikata, Yuji; Nodomi, Yuki; Ohnishi, Risa; Kizu, Asako; Konno, Hideo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 17
• Pages of publication: 8021 - 8030
• a: 10.2132 ± 0.0004 Å
• b: 30.9988 ± 0.0011 Å
• c: 16.2427 ± 0.0006 Å
• α: 90°
• β: 95.006 ± 0.002°
• γ: 90°
• Cell volume: 5122.8 ± 0.3 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1021
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.148
• Weighted residual factors for all reflections included in the refinement: 0.1693
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No