Information card for entry 7235491

Structure parameters

• Formula: C31 H21 Cl3 N6 Ni O2
• Calculated formula: C31 H21 Cl3 N6 Ni O2
• Title of publication: Selective colorimetric and ratiometric probe for Ni(ii) in quinoxaline matrix with the single crystal X-ray structure
• Authors of publication: Goswami, Shyamaprosad; Chakraborty, Shampa; Das, Avijit Kumar; Manna, Abhishek; Bhattacharyya, Aditya; Quah, Ching Kheng; Fun, Hoong-Kun
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 40
• Pages of publication: 20922
• a: 9.6004 ± 0.0009 Å
• b: 10.577 ± 0.001 Å
• c: 14.3427 ± 0.0014 Å
• α: 82.418 ± 0.002°
• β: 81.231 ± 0.002°
• γ: 80.012 ± 0.002°
• Cell volume: 1409.2 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0822
• Residual factor for significantly intense reflections: 0.0756
• Weighted residual factors for significantly intense reflections: 0.1898
• Weighted residual factors for all reflections included in the refinement: 0.1973
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No