Information card for entry 4315830

Structure parameters

• Formula: C43 H85 Er N6 Si4
• Calculated formula: C43 H85 Er N6 Si4
• SMILES: [Er]123456([N](=C(N1C1CCCCC1)N([Si](C)(C)C)[Si](C)(C)C)C1CCCCC1)([N](C1CCCCC1)=C(N2C1CCCCC1)N([Si](C)(C)C)[Si](C)(C)C)[cH]1[cH]3[cH]4[cH]5[cH]61
• Title of publication: Activation of Bis(guanidinate)lanthanide Alkyl and Aryl Complexes on Elemental Sulfur: Synthesis and Characterization of Bis(guanidinate)lanthanide Thiolates and Disulfides
• Authors of publication: Zhengxing Zhang; Lixin Zhang; Yanrong Li; Longcheng Hong; Zhenxia Chen; Xigeng Zhou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 5715 - 5722
• a: 10.445 ± 0.004 Å
• b: 13.808 ± 0.006 Å
• c: 18.877 ± 0.008 Å
• α: 79.621 ± 0.005°
• β: 81.2 ± 0.005°
• γ: 75.858 ± 0.005°
• Cell volume: 2579.8 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0499
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No