(5R,6S)-3-{[(2Z)-2-(Dimethylamino)-2-(Methylimino)Ethyl]Sulfanyl}-6-[(1R)-1-Fluoroethyl]-7-Oxo-1-Azabicyclo[3.2.0]Hept-2-Ene-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C14H20FN3O3S
IUPAC Name (5r,6s)-3-[(2z)-2-(dimethylamino)-2-methylimino-ethyl]sulfanyl-6-[(1r)-1-fluoroethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Molecular Mass 329.390 g·mol−1
Heat of Formation -497.9 ± 16.7 kJ·mol−1
Dipole Moment 3.07 ± 1.08 D
Volume 387.78 Å 3
Surface Area 328.86 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
InChIKey PCZBRDGZHMHPIE-NFXQZBBISA-N
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