N-{[(1-Carboxyethyl)Amino]Methyl}Histidine

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Formula C10H16N4O4
IUPAC Name (2s)-2-[[[(1s)-1-carboxyethyl]amino]methylamino]-3-imidazol-3-ium-4-ylium-4-yl-propanoic acid
Molecular Mass 256.258 g·mol−1
Heat of Formation -647.9 ± 16.7 kJ·mol−1
Dipole Moment 4.91 ± 1.08 D
Volume 302.84 Å 3
Surface Area 273.2 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 0.45 ± eV
Point Group Symmetry C1
InChIKey HQALXSNWXVRIFR-XPUUQOCRSA-N
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