Information card for entry 7024615

Structure parameters

• Formula: C40 H21 Cl0 Er F18 N4 O8 Zn
• Calculated formula: C40 H21 Er F18 N4 O8 Zn
• Title of publication: Square structures and photophysical properties of Zn(2)Ln(2) complexes (Ln = Nd, Eu, Sm, Er, Yb).
• Authors of publication: Xu, Hai-Bing; Wen, Hui-Min; Chen, Zhong-Hui; Li, Jia; Shi, Lin-Xi; Chen, Zhong-Ning
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 8
• Pages of publication: 1948 - 1953
• a: 14.606 ± 0.004 Å
• b: 16.749 ± 0.004 Å
• c: 18.991 ± 0.005 Å
• α: 90°
• β: 107.968 ± 0.003°
• γ: 90°
• Cell volume: 4419 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.0645
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.1648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.235
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No