Information card for entry 1540409

Structure parameters

• Formula: C24 H18 Fe Gd N8 Ni O11
• Calculated formula: C24 H18 Fe Gd N8 Ni O11
• SMILES: C([Fe](C#N)(C#N)(C#N)(C#N)C#N)#[N][Gd]123([O]4c5c(cccc5C=[N]5CC[N]6=Cc7cccc(c7[O]1[Ni]456)[O]3C)[O]2C)([OH2])([OH2])([OH2])[OH2].O.O.O
• Title of publication: Construction of Ni(II)Ln(III)M(III) (Ln = Gd(III), Tb(III); M = Fe(III), Cr(III)) clusters showing slow magnetic relaxations.
• Authors of publication: Chen, Chao; Liu, Yashu; Li, Ping; Zhou, Hongbo; Shen, Xiaoping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 46
• Pages of publication: 20193 - 20199
• a: 12.862 ± 0.003 Å
• b: 12.012 ± 0.002 Å
• c: 21.58 ± 0.004 Å
• α: 90°
• β: 106.72 ± 0.03°
• γ: 90°
• Cell volume: 3193.1 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0397
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0823
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No