Information card for entry 4061701

Structure parameters

• Formula: C16 H32 O4 S2 Ti
• Calculated formula: C16 H32 O4 S2 Ti
• SMILES: C1(C)(CSCC(C)(O[Ti]2(O1)OC(C)(C)CSCC(C)(C)O2)C)C
• Authors of publication: Carpentier; Lehmann
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 17.718 ± 0.001 Å
• b: 12.194 ± 0.001 Å
• c: 9.611 ± 0.001 Å
• α: 90°
• β: 94.447 ± 0.003°
• γ: 90°
• Cell volume: 2070.2 ± 0.3 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No