Information card for entry 4347513

Structure parameters

• Formula: C18 H34 Cl Na O9 Si2
• Calculated formula: C18 H34 Cl Na O9 Si2
• SMILES: [O]1=Cl(O[Na]23451[O]1CC[O]5CC[O]3[Si](C)(C)[Si](C)(C)[O]4CC[O]2CC1)(=O)=O.c1ccccc1
• Title of publication: Stable Alkali-Metal Complexes of Hybrid Disila-Crown Ethers.
• Authors of publication: Reuter, Kirsten; Buchner, Magnus R.; Thiele, Günther; von Hänisch, Carsten
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4441 - 4447
• a: 9.8536 ± 0.0005 Å
• b: 9.9654 ± 0.0005 Å
• c: 13.0638 ± 0.0006 Å
• α: 91.291 ± 0.002°
• β: 92.82 ± 0.002°
• γ: 97.259 ± 0.002°
• Cell volume: 1270.44 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0474
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No