Information card for entry 7101914

Structure parameters

• Formula: C58 H86 N14 O2 Yb4
• Calculated formula: C58 H86 N14 O2 Yb4
• SMILES: [Yb]235789%10([O]4[Yb]%11%13%15%16%17%18([N]%19%20[Yb]4%21%24%25%26%27([N](c%28cccc([n]3%28)[N]32[Yb]2%29%30%31%32([N](=C3NC(C)C)C(C)C)([N](c1[n]%11c%19ccc1)C(=[N]2C(C)C)NC(C)C)([O]5%13)[cH]1[cH]%29[cH]%30[cH]%31[cH]%321)C(=[N]%21C(C)C)NC(C)C)([N](=C%20NC(C)C)C(C)C)[cH]1[cH]%27[cH]%26[cH]%25[cH]%241)[cH]1[cH]%18[cH]%17[cH]%16[cH]%151)[cH]1[cH]%10[cH]9[cH]8[cH]71
• Title of publication: Synthesis and structural characterization of lanthanide complexes with the di- or tri-anionic diguanidinate ligand: new insight into the flexibility and distinct reactivity of the linked diguanidinate ligand.
• Authors of publication: Pi, Chengfu; Zhu, Zhenyu; Weng, Linhong; Chen, Zhenxia; Zhou, Xigeng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 21
• Pages of publication: 2190 - 2192
• a: 26.666 ± 0.008 Å
• b: 10.629 ± 0.003 Å
• c: 26.163 ± 0.008 Å
• α: 90°
• β: 111.655 ± 0.005°
• γ: 90°
• Cell volume: 6892 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1224
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1274
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 0.859
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No