L-Alanyl-D-Histidine

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Properties Simple | Detailed

Formula C9H14N4O3
IUPAC Name (2r)-2-[[(2s)-2-aminopropanoyl]amino]-3-imidazol-3-ium-4-ylium-4-yl-propanoic acid
Molecular Mass 226.232 g·mol−1
Heat of Formation -455.3 ± 16.7 kJ·mol−1
Dipole Moment 6.68 ± 1.08 D
Volume 269.52 Å 3
Surface Area 238.35 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 0.17 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-(alanylamino)-3-(3h-imidazol-4-yl)propionic acid
  • (2r)-2-[[(2s)-2-amino-1-oxopropyl]amino]-3-(3h-imidazol-4-yl)propanoic acid
  • (2r)-2-[[(2s)-2-aminopropanoyl]amino]-3-(3h-imidazol-4-yl)propanoic acid
  • ala-his
InChIKey XZWXFWBHYRFLEF-CAHLUQPWSA-N
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