Information card for entry 4346579

Structure parameters

• Formula: C166 H184 Eu2 N22 O23
• Calculated formula: C166 H184 Eu2 N22 O23
• SMILES: [Eu]123456(n7c8=Nc9[n]1c(=Nc1n2c(N=c2[n]3c(N=c7c3c8cc(OCCCC)c(OCCCC)c3)c3cc(OCCCC)c(OCCCC)cc23)c2cc(OCCCC)c(OCCCC)cc12)c1cc(OCCCC)c(OCCCC)cc91)[n]12[Eu]3789%10([n]%114c4ccc%11=C(c%11ccc([n]53%11)C(=c3ccc([n]673)c1ccc2C=4c1ccc(N(=O)=O)cc1)c1ccc(N(=O)=O)cc1)c1ccccc1)[n]1c2=Nc3n%10c(N=c4[n]9c(N=c5n8c(=Nc1c1c2cc(OCCCC)c(OCC[CH]C)c1)c1cc(OCCCC)c(OCCCC)cc51)c1cc(OCCCC)c(OCCCC)cc41)c1cc(OCCCC)c(OCCCC)cc31.O.O.OC
• Title of publication: Europium triple-decker complexes containing phthalocyanine and nitrophenyl-corrole macrocycles.
• Authors of publication: Lu, Guifen; Li, Jing; Jiang, Xiaoqin; Ou, Zhongping; Kadish, Karl M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 18
• Pages of publication: 9211 - 9222
• a: 28.87 ± 0.006 Å
• b: 23.02 ± 0.005 Å
• c: 24.01 ± 0.005 Å
• α: 90°
• β: 102.65 ± 0.03°
• γ: 90°
• Cell volume: 15569 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1269
• Residual factor for significantly intense reflections: 0.1198
• Weighted residual factors for significantly intense reflections: 0.2864
• Weighted residual factors for all reflections included in the refinement: 0.2935
• 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