(6R,7R)-3-[[(1S,2R)-5-Amino-1-(2-Hydroxyethyl)-3H-Pyrazol-3-Id-2-Yl]Methyl]-7-[[(2Z)-2-(2-Amino-5H-Thiazol-3-Ium-5-Id-4-Yl)-2-Methoxyimino-Acetyl]Amino]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate

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Formula C19H25N8O6S2
IUPAC Name (6r,7r)-3-[[(1s,2r)-5-amino-1-(2-hydroxyethyl)-3h-pyrazol-3-id-2-yl]methyl]-7-[[(2z)-2-(2-amino-5h-thiazol-3-ium-5-id-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Molecular Mass 525.582 g·mol−1
Heat of Formation -204.3 ± 16.7 kJ·mol−1
Dipole Moment 19.51 ± 1.08 D
Volume 558.82 Å 3
Surface Area 447.88 Å 2
HOMO Energy -8.15 ± 0.55 eV
LUMO Energy -1.46 ± eV
Point Group Symmetry C1
InChIKey LTOXLHBXGXBEBI-NORFKXNASA-N
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