N-(4-Carboxy-2-Hydroxybutanoyl)-L-Histidyl-L-Prolinamide

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Properties Simple | Detailed

Formula C16H23N5O6
IUPAC Name (4s)-5-[[(1s)-2-[(2s)-2-carbamoylpyrrolidin-1-yl]-1-(imidazol-3-ium-4-ylium-4-ylmethyl)-2-oxo-ethyl]amino]-4-hydroxy-5-oxo-pentanoic acid
Molecular Mass 381.384 g·mol−1
Heat of Formation -1052.5 ± 16.7 kJ·mol−1
Dipole Moment 6.34 ± 1.08 D
Volume 449.73 Å 3
Surface Area 377.89 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
InChIKey QTSAHVCUJWDFEQ-SRVKXCTJSA-N
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