Information card for entry 7715697

Structure parameters

• Formula: C32 H54 Gd2 N4 O34 S4
• Calculated formula: C32 H54 Gd2 N4 O34 S4
• Title of publication: Lanthanide complexes with an azo-dye chromophore ligand: syntheses, crystal structures, and near-infrared luminescence by long-wavelength excitation.
• Authors of publication: Chen, Yun-Long; Feng, Min; Zhu, Xiaofei; Zheng, Zhiping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 17
• Pages of publication: 7350 - 7357
• a: 15.2177 ± 0.001 Å
• b: 7.4551 ± 0.0004 Å
• c: 23.3788 ± 0.0013 Å
• α: 90°
• β: 107.394 ± 0.002°
• γ: 90°
• Cell volume: 2531 ± 0.3 ų
• Cell temperature: 99.99 K
• Ambient diffraction temperature: 99.99 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: 0.0538
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No