(3S)-2-Oxo-3-[[(2R)-2-Phenyl-2-Sulfo-Acetyl]Amino]Azetidine-1-Sulfonic Acid

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Properties Simple | Detailed

Formula C11H12N2O8S2
IUPAC Name (3s)-2-oxo-3-[[(2r)-2-phenyl-2-sulfo-acetyl]amino]azetidine-1-sulfonic acid
Molecular Mass 364.352 g·mol−1
Heat of Formation -1213.0 ± 16.7 kJ·mol−1
Dipole Moment 3.54 ± 1.08 D
Volume 364.03 Å 3
Surface Area 320.66 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey POSHFKDGEUNGMD-DTWKUNHWSA-N
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