{5-Oxo-4-[(4-Oxo-2,5-Cyclohexadien-1-Yl)Methyl]-1-(2-Oxoethyl)-4,5-Dihydro-1H-Imidazol-2-Yl}Methanaminium

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Properties Simple | Detailed

Formula C13H15N3O3
IUPAC Name 2-[(4s)-2-(aminomethyl)-5-oxo-4-[(4-oxocyclohexa-2,5-dien-1-yl)methyl]-4h-imidazol-1-yl]acetaldehyde
Molecular Mass 261.276 g·mol−1
Heat of Formation -215.1 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 314.53 Å 3
Surface Area 286.66 Å 2
HOMO Energy -10.08 ± 0.55 eV
LUMO Energy 2.33 ± eV
Point Group Symmetry C1
InChIKey MONOYMGQJZJGBR-NSHDSACASA-N
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