Information card for entry 4101206

Structure parameters

• Formula: C34 H50 N2 O3 S Si
• Calculated formula: C34 H50 N2 O3 S Si
• SMILES: [C@]12([C@H]([C@H](c3c4c(ccn24)ccc3)O)CCCC1)C[S@](c1ccc(cc1)C)(=N[C@H](CO[Si](C)(C)C(C)(C)C)C(C)C)=O
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• a: 7.38 ± 0.002 Å
• b: 14.304 ± 0.003 Å
• c: 16.996 ± 0.008 Å
• α: 90°
• β: 93.16 ± 0.03°
• γ: 90°
• Cell volume: 1791.4 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No