Information card for entry 4115991

Structure parameters

• Formula: C36 H51 Dy N6 O15
• Calculated formula: C36 H51 Dy N6 O15
• SMILES: [Dy]123([O]=N(=O)O1)([O]=N(=O)O2)([O]=N(=O)O3)(Oc1c(ccc(OC)c1)/C=[NH+]/CCCC)(Oc1c(ccc(OC)c1)/C=[NH+]/CCCC)Oc1c(ccc(OC)c1)/C=[NH+]/CCCC
• Title of publication: Rare-Earth-Containing Magnetic Liquid Crystals
• Authors of publication: Koen Binnemans; Yury G. Galyametdinov; Rik Van Deun; Duncan W. Bruce; Simon R. Collinson; Arkadiy P. Polishchuk; Ildar Bikchantaev; Wolfgang Haase; Andrey V. Prosvirin; Larisa Tinchurina; Igor Litvinov; Ajdar Gubajdullin; Ajdar Rakhmatullin; Koen Uytterhoeven; Luc Van Meervelt
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2000
• Journal volume: 122
• Pages of publication: 4335 - 4344
• a: 11.38 ± 0.001 Å
• b: 13.8 ± 0.005 Å
• c: 14.03 ± 0.005 Å
• α: 98.7 ± 0.03°
• β: 98.15 ± 0.02°
• γ: 92.67 ± 0.02°
• Cell volume: 2150.8 ± 1.1 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.03
• Goodness-of-fit parameter for significantly intense reflections: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No