(2R,5R,6R)-6-{[(2R)-2-Carboxylato-2-Phenylacetyl]Amino}-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate

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Properties Simple | Detailed

Formula C17H16N2O6S--
IUPAC Name (2s,5r,6r)-6-[[(2s)-2-carboxylato-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Molecular Mass 376.384 g·mol−1
Heat of Formation -711.1 ± 16.7 kJ·mol−1
Dipole Moment 3.28 ± 1.08 D
Volume 471.99 Å 3
Surface Area 354.68 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey FPPNZSSZRUTDAP-BBGACYKPSA-L
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