3-{[Amino(Phenyl)Acetyl]Amino}-2-Methyl-4-Oxo-1-Azetidinesulfonic Acid

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Formula C12H15N3O5S
IUPAC Name (2s,3s)-3-[[(2r)-2-amino-2-phenyl-acetyl]amino]-2-methyl-4-oxo-azetidine-1-sulfonic acid
Molecular Mass 313.330 g·mol−1
Heat of Formation -704.3 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 349.44 Å 3
Surface Area 304.97 Å 2
HOMO Energy -9.81 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
InChIKey SVUBAFISKHWUBZ-SFGNSQDASA-N
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