Information card for entry 4060712

Structure parameters

• Formula: C21 H44 Ge N4 Si3
• Calculated formula: C21 H44 Ge N4 Si3
• SMILES: [Ge]12(N([Si](C)(C)C)CCN(CCN1[Si](C)(C)C)CCN2[Si](C)(C)C)c1ccccc1
• Title of publication: Azametallatranes of Group 14 Elements. Syntheses and X-ray Studies
• Authors of publication: Shutov, Pavel L.; Sorokin, Denis A.; Karlov, Sergey S.; Harms, Klaus; Oprunenko, Yuri F.; Churakov, Andrei V.; Antipin, Mikhail Yu.; Zaitseva, Galina S.; Lorberth, Jörg
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 3
• Pages of publication: 516 - 522
• a: 20.381 ± 0.0006 Å
• b: 20.381 ± 0.0006 Å
• c: 34.7323 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 12494.4 ± 0.7 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 161
• Hermann-Mauguin space group symbol: R 3 c :H
• Hall space group symbol: R 3 -2"c
• Residual factor for all reflections: 0.0346
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.0532
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No