Chloromethyl (7S)-7-Acetamido-1,3-Dimethoxy-10-(Methylsulfanyl)-9-Oxo-5,6,7,9-Tetrahydrobenzo[A]Heptalene-2-Carboxylate

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Formula C23H24ClNO6S
IUPAC Name chloromethyl (7s)-7-acetamido-1,3-dimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5h-benzo[a]heptalene-2-carboxylate
Molecular Mass 477.958 g·mol−1
Heat of Formation -821.0 ± 16.7 kJ·mol−1
Dipole Moment 5.64 ± 1.08 D
Volume 546.18 Å 3
Surface Area 415.74 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
InChIKey ZSPDEGWRRUIQQA-INIZCTEOSA-N
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Elements C Cl H O N S