Diphenylmethyl (6R,7R)-3,4-Bis(Methylene)-8-Oxo-7-[(2-Thienylacetyl)Amino]-5-Thia-1-Azabicyclo[4.2.0]Octane-2-Carboxylate

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Properties Simple | Detailed

Formula C28H24N2O4S2
IUPAC Name benzhydryl (2s,6s,7r)-3,4-dimethylene-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate
Molecular Mass 516.631 g·mol−1
Heat of Formation -108.3 ± 16.7 kJ·mol−1
Dipole Moment 3.48 ± 1.08 D
Volume 603.3 Å 3
Surface Area 496.34 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 2.37 ± eV
Point Group Symmetry C1
InChIKey GNOIMVIYXFSDID-DXBVXKBHSA-N
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