Information card for entry 7701790

Structure parameters

• Formula: C54 H46 Cd Cl2 N6 O11
• Calculated formula: C54 H44 Cd Cl2 N6 O11
• Title of publication: Methoxy-substituted tetrakisquinoline analogs of EGTA and BAPTA for fluorescence detection of Cd²⁺ .
• Authors of publication: Mikata, Yuji; Kaneda, Minori; Konno, Hideo; Matsumoto, Arimasa; Sato, Shin-Ichiro; Kawamura, Masaya; Iwatsuki, Satoshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 3840 - 3852
• a: 15.4421 ± 0.0008 Å
• b: 15.5215 ± 0.0008 Å
• c: 20.5748 ± 0.001 Å
• α: 90°
• β: 92.922 ± 0.003°
• γ: 90°
• Cell volume: 4925.1 ± 0.4 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 6
• 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: 0.057
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1492
• Weighted residual factors for all reflections included in the refinement: 0.1562
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No