5-Oxo-L-Prolyl-3-(4H-Imidazol-4-Yl)-D-Alanine

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Properties Simple | Detailed

Formula C11H14N4O4
IUPAC Name (2s)-3-[(4s)-4h-imidazol-4-yl]-2-[[(2s)-5-oxopyrrolidine-2-carbonyl]amino]propanoic acid
Molecular Mass 266.253 g·mol−1
Heat of Formation -523.3 ± 16.7 kJ·mol−1
Dipole Moment 6.44 ± 1.08 D
Volume 309.18 Å 3
Surface Area 274.45 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy -1.14 ± eV
Point Group Symmetry C1
InChIKey DDQCRHMAPMBAFL-FXQIFTODSA-N
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