[(3S)-2,5-Dioxo-3-Sulfo-Pyrrolidin-1-Yl] 3-[2-[(4-Azido-2-Hydroxy-Benzoyl)Amino]Ethyldisulfanyl]Propanoate

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Formula C16H20N5O9S3
IUPAC Name [(3s)-2,5-dioxo-3-sulfo-pyrrolidin-1-yl] 3-[2-[(4-azido-2-hydroxy-benzoyl)amino]ethyldisulfanyl]propanoate
Molecular Mass 522.553 g·mol−1
Heat of Formation -1046.8 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 532.1 Å 3
Surface Area 404.47 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey JSCRKXPTTLPYSJ-LBPRGKRZSA-N
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