Information card for entry 7023927

Structure parameters

• Formula: C28 H35 Cl2 Cu N5 O5
• Calculated formula: C28 H31 Cl2 Cu N5 O5
• Title of publication: A regeneratable and highly selective fluorescent probe for sulfide detection in aqueous solution.
• Authors of publication: Wu, Xiaojing; Li, Hongda; Kan, Yuhe; Yin, Bingzhu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 46
• Pages of publication: 16302 - 16310
• a: 10.955 ± 0.002 Å
• b: 12.245 ± 0.002 Å
• c: 13.837 ± 0.003 Å
• α: 64.56 ± 0.03°
• β: 79.15 ± 0.03°
• γ: 68.15 ± 0.03°
• Cell volume: 1554.9 ± 0.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0848
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1913
• Weighted residual factors for all reflections included in the refinement: 0.2082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No