6-[Hydroxy(Phenyl)Methyl]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid 4,4-Dioxide

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Formula C15H17NO6S
IUPAC Name (2r,5s,6r)-6-[(s)-hydroxy(phenyl)methyl]-3,3-dimethyl-4,4,7-trioxo-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Molecular Mass 339.364 g·mol−1
Heat of Formation -851.2 ± 16.7 kJ·mol−1
Dipole Moment 1.88 ± 1.08 D
Volume 371.69 Å 3
Surface Area 305.6 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey YJZNAALQLKUXNT-UZWSLXQKSA-N
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