{(4Z)-2-[(1R,2R)-1-Amino-2-Hydroxypropyl]-4-[(4-Amino-1H-Indol-3-Yl)Methylene]-5-Oxo-4,5-Dihydro-1H-Imidazol-1-Yl}Acetic Acid

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Properties Simple | Detailed

Formula C17H19N5O4
IUPAC Name 2-[(4z)-2-[(1r,2r)-1-amino-2-hydroxy-propyl]-4-[(4-amino-2h-indol-1-ium-2-ylium-3-yl)methylene]-5-oxo-imidazol-1-yl]acetic acid
Molecular Mass 357.364 g·mol−1
Heat of Formation -433.8 ± 16.7 kJ·mol−1
Dipole Moment 2.44 ± 1.08 D
Volume 408.69 Å 3
Surface Area 358.2 Å 2
HOMO Energy -8.01 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
InChIKey JUWJATLABHTRDF-JURWUIOISA-N
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