Information card for entry 7715453

Structure parameters

• Formula: C42 H42 Gd N5 O13 Zn2
• Calculated formula: C42 H42 Gd N5 O13 Zn2
• Title of publication: Effect of diamagnetic Zn(II) ions on the SMM properties of a series of trinuclear ZnDy₂ and tetranuclear Zn₂Dy₂ (Ln^III = Dy, Tb, Gd) complexes: combined experimental and theoretical studies.
• Authors of publication: Shukla, Pooja; Tarannum, Ibtesham; Roy, Soumalya; Rajput, Amit; Lama, Prem; Singh, Saurabh Kumar; Kłak, Julia; Lee, Junseong; Das, Sourav
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 7053 - 7066
• a: 11.9328 ± 0.001 Å
• b: 20.8385 ± 0.0018 Å
• c: 18.2495 ± 0.0015 Å
• α: 90°
• β: 106.152 ± 0.002°
• γ: 90°
• Cell volume: 4358.8 ± 0.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• 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: 0.0677
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1457
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No