N-{1-[(Carboxymethyl)Amino]-1-Oxo-3-Sulfanyl-2-Butanyl}Glutamine

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Formula C11H19N3O6S
IUPAC Name (2s)-2-amino-5-[[(1s,2r)-1-(carboxymethylcarbamoyl)-2-sulfanyl-propyl]amino]-5-oxo-pentanoic acid
Molecular Mass 321.350 g·mol−1
Heat of Formation -1147.0 ± 16.7 kJ·mol−1
Dipole Moment 6.40 ± 1.08 D
Volume 375.44 Å 3
Surface Area 334.1 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey GYHXNGRPRPFNOF-QIOHGKGESA-N
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