Information card for entry 7113618

Structure parameters

• Formula: C85 H73 Cl3 Eu N16 O4
• Calculated formula: C85 H62.5 Cl3 Eu N16 O4
• Title of publication: Synthesis, spectroscopic characterisation and structure of the first chiral heteroleptic bis(phthalocyaninato) rare earth complexes
• Authors of publication: Bian, Yongzhong; Wang, Rongming; Jiang, Jianzhuang; Lee, Chi-Hang; Wang, Jinzhi; Ng, Dennis K. P.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 10
• Pages of publication: 1194 - 1195
• a: 21.043 ± 0.001 Å
• b: 17.4463 ± 0.0008 Å
• c: 21.043 ± 0.001 Å
• α: 90°
• β: 90.262 ± 0.001°
• γ: 90°
• Cell volume: 7725.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1608
• Residual factor for significantly intense reflections: 0.0693
• Weighted residual factors for significantly intense reflections: 0.1777
• Weighted residual factors for all reflections included in the refinement: 0.2264
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7103644
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No