N-{N-[3-(1H-Imidazol-4-Yl)Propyl]Carbamimidoyl}Acetamide

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Properties Simple | Detailed

Formula C9H15N5O
IUPAC Name n-[(e)-n'-(3-imidazol-3-ium-4-ylium-4-ylpropyl)carbamimidoyl]acetamide
Molecular Mass 209.248 g·mol−1
Heat of Formation -72.8 ± 16.7 kJ·mol−1
Dipole Moment 4.87 ± 1.08 D
Volume 264.38 Å 3
Surface Area 246.61 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
InChIKey PWESNUDCWDBFNS-UHFFFAOYSA-N
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