Information card for entry 7057266

Structure parameters

• Formula: C49 H36 Cl2 Co N4 O
• Calculated formula: C49 H36 Cl2 Co N4 O
• Title of publication: ESIPT-capable 2,6-di(1H-imidazol-2-yl)phenols with very strong fluorescent sensing signals towards Cr(iii), Zn(ii), and Cd(ii): molecular variation effects on turn-on efficiency
• Authors of publication: Eseola, Abiodun O.; Görls, Helmar; Bangesh, Masroor; Plass, Winfried
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 10
• Pages of publication: 7884
• a: 10.9294 ± 0.0004 Å
• b: 11.1711 ± 0.0003 Å
• c: 17.8224 ± 0.0004 Å
• α: 75.494 ± 0.002°
• β: 83.788 ± 0.002°
• γ: 71.54 ± 0.001°
• Cell volume: 1997.24 ± 0.1 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0648
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No