(3E)-2-Amino-4-[5-(2-Amino-2-Carboxyethyl)-1,1,3-Trimethyl-2,3-Dihydro-1H-Imidazol-1-Ium-2-Yl]-3-Butenoate

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Properties Simple | Detailed

Formula C13H22N4O4
IUPAC Name (e,2r)-2-amino-4-[(2s)-5-[(2s)-2-amino-2-carboxy-ethyl]-1,1,3-trimethyl-2h-imidazol-1-ium-2-yl]but-3-enoate
Molecular Mass 298.338 g·mol−1
Heat of Formation 1195.6 ± 16.7 kJ·mol−1
Dipole Moment 3.75 ± 1.08 D
Volume 327.24 Å 3
Surface Area 293.47 Å 2
HOMO Energy -9.97 ± 0.55 eV
LUMO Energy -2.29 ± eV
Point Group Symmetry C1
InChIKey LBAPXSZOLVAGQW-OXMQDWPZSA-N
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