Information card for entry 7217896

Structure parameters

• Formula: C25 H29 N2 O3 P S2
• Calculated formula: C25 H29 N2 O3 P S2
• Title of publication: A mononuclear Dy(III) complex incoporating dithienylethene unit: crystalline-phase photochromism, magnetic and luminescent properties
• Authors of publication: Cao, Deng-Ke; Wei, Ruo-Hong; Gu, Yan-Wei; Zhao, Yue; Ward, Mike D.
• Journal of publication: RSC Adv.
• Year of publication: 2014
• a: 8.103 ± 0.003 Å
• b: 8.097 ± 0.003 Å
• c: 40.015 ± 0.014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2625.4 ± 1.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0949
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.1576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No