Information card for entry 2237416

Structure parameters

• Chemical name: {Bis[<i>N</i>,<i>N</i>'-dicyclohexyl-<i>N</i>'',<i>N</i>''-bis(trimethylsilyl)guanidinato-κ^2^<i>N</i>,<i>N</i>']neodymium(III)}di-μ-chlorido-[bis(tetrahydrofuran-κ<i>O</i>)lithium]
• Formula: C46 H96 Cl2 Li N6 Nd O2 Si4
• Calculated formula: C46 H96 Cl2 Li N6 Nd O2 Si4
• SMILES: [Nd]123([Cl][Li]([Cl]1)([O]1CCCC1)[O]1CCCC1)([N](=C(N2C1CCCCC1)N([Si](C)(C)C)[Si](C)(C)C)C1CCCCC1)[N](=C(N3C1CCCCC1)N([Si](C)(C)C)[Si](C)(C)C)C1CCCCC1
• Title of publication: {Bis[<i>N</i>,<i>N</i>'-dicyclohexyl-<i>N</i>'',<i>N</i>''-bis(trimethylsilyl)guanidinato-κ^2^<i>N</i>,<i>N</i>']neodymium(III)}di-μ-chlorido-[bis(tetrahydrofuran-κ<i>O</i>)lithium]
• Authors of publication: Chi, Shu-Hui; Chen, Jue
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 2
• Pages of publication: m121
• a: 24.1739 ± 0.0016 Å
• b: 13.5238 ± 0.0008 Å
• c: 18.8108 ± 0.0013 Å
• α: 90°
• β: 103.215 ± 0.002°
• γ: 90°
• Cell volume: 5986.8 ± 0.7 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• 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: 0.06
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes