Information card for entry 4318680

Structure parameters

• Formula: C38 H68 Ca N2 O2 Si2
• Calculated formula: C38 H68 Ca N2 O2 Si2
• SMILES: [Ca](N(c1c(cccc1C(C)C)C(C)C)[Si](C)(C)C)(N(c1c(cccc1C(C)C)C(C)C)[Si](C)(C)C)([O]1CCCC1)[O]1CCCC1
• Title of publication: A Novel Group of Alkaline Earth Metal Amides: Syntheses and Characterization of M[N(2,6-iPr2C6H3)(SiMe3)]2(THF)2 (M = Mg, Ca, Sr, Ba) and the Linear, Two-Coordinate Mg[N(2,6-iPr2C6H3)(SiMe3)]2
• Authors of publication: Wilda Vargas; Ulrich Englich; Karin Ruhlandt-Senge
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5602 - 5608
• a: 9.7074 ± 0.0001 Å
• b: 20.9466 ± 0.0004 Å
• c: 21.6242 ± 0.0003 Å
• α: 73.573 ± 0.001°
• β: 78.632 ± 0.001°
• γ: 89.621 ± 0.001°
• Cell volume: 4129.13 ± 0.11 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0902
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.1376
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No