Information card for entry 7036613

Structure parameters

• Formula: C115 H95 Cu F66 Gd3 N8 O38
• Calculated formula: C115 H95 Cu F66 Gd3 N8 O38
• Title of publication: Nitronyl nitroxide based 2p-3d-4f chains with the magnetocaloric effect and slow magnetic relaxation.
• Authors of publication: Wang, Xiufeng; Li, Cun; Sun, Juan; Li, Licun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 42
• Pages of publication: 18411 - 18417
• a: 19.808 ± 0.002 Å
• b: 22.168 ± 0.003 Å
• c: 33.918 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14894 ± 3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1168
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No