Information card for entry 7246078

Structure parameters

• Formula: C48 H55 Co2 Dy2 N12 O25.5
• Calculated formula: C44 H44 Co2 Dy2 N10 O23
• SMILES: c1cccc2C34c5cccc[n]5[Co]56([n]12)([n]1ccccc1C(c1cccc[n]61)(=[O]5)OC)[O]=4[Dy]12456(ON(=[O]5)=O)[O]3[Dy]357(ON(=[O]3)=O)(ON(=[O]7)=O)(ON(=[O]5)=O)([O]6CC3C[O]4[Co]456([N](=Cc7c(cccc7)O4)C(C[OH]1)C[O]25)[N]3=Cc1c(cccc1)O6)[OH]C
• Title of publication: Modulating the structural topologies from star-shape to cross-shape for Co–Dy heterometallic complexes with slow magnetic relaxation behavior
• Authors of publication: Wang, Hui-Sheng; Yu, Chun-Fang; Ye, Si-Qi; Chen, Yong; Liu, Xueru; Wu, Yanfang; Zhou, Pengfei; Zhang, Yi-Quan
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 5
• Pages of publication: 726 - 737
• a: 11.9878 ± 0.0017 Å
• b: 13.463 ± 0.0019 Å
• c: 19.444 ± 0.003 Å
• α: 103.072 ± 0.002°
• β: 97.912 ± 0.002°
• γ: 100.201 ± 0.002°
• Cell volume: 2956.3 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0736
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.146
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No