Ceftobiprole

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Formula C20H22N8O6S2
IUPAC Name (6r,7r)-7-[[(2e)-2-(5-amino-1,2,4-thiadiazol-3-ylidene)-2-nitroso-acetyl]amino]-8-oxo-3-[(e)-[2-oxo-1-[(3r)-pyrrolidin-3-yl]pyrrolidin-3-ylidene]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Mass 534.569 g·mol−1
Heat of Formation -313.1 ± 16.7 kJ·mol−1
Dipole Moment 6.82 ± 1.08 D
Volume 572.37 Å 3
Surface Area 475.33 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -1.99 ± eV
Point Group Symmetry C1
InChIKey LXLDMYXULSBRCX-KOGKARRDSA-N
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