N-(3-Carboxypropanoyl)-L-Valyl-N-[(1R)-2-Phenyl-1-Phosphonoethyl]-L-Prolinamide

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Properties Simple | Detailed

Formula C22H32N3O8P
IUPAC Name 4-[[(1s)-1-[(2s)-2-[[(1r)-1-dihydroxyphosphoryl-2-phenyl-ethyl]carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid
Molecular Mass 497.479 g·mol−1
Heat of Formation -1752.3 ± 16.7 kJ·mol−1
Dipole Moment 5.70 ± 1.08 D
Volume 583.07 Å 3
Surface Area 475.69 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy 0.23 ± eV
Point Group Symmetry C1
InChIKey KPGFVOVOBVGIMY-QRFRQXIXSA-N
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