Information card for entry 4080597

Structure parameters

• Formula: C75 H71 N O3 Si3 Sn
• Calculated formula: C75 H71 N O3 Si3 Sn
• SMILES: [Sn](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1.[NH+](Cc1ccccc1)(C)C.c1ccccc1.c1ccccc1
• Title of publication: Unusual Reactivity of a C,N-Chelated Stannylene with Siloxanes and Silanols
• Authors of publication: Padělková, Zdeňka; Švec, Petr; Kampová, Hana; Sýkora, Jan; Semler, Miloslav; Štěpnička, Petr; Bakardjieva, Snejana; Willem, Rudolph; Růžička, Aleš
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 8
• Pages of publication: 2398
• a: 9.9502 ± 0.001 Å
• b: 14.2312 ± 0.001 Å
• c: 23.4769 ± 0.0019 Å
• α: 75.928 ± 0.009°
• β: 87.302 ± 0.009°
• γ: 76.82 ± 0.006°
• Cell volume: 3139.6 ± 0.5 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0484
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0621
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No