3-Amino-4-(1H-Imidazol-5-Yl)-2-Butanone

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Properties Simple | Detailed

Formula C7H11N3O
IUPAC Name (3s)-3-amino-4-(1h-imidazol-5-yl)butan-2-one
Molecular Mass 153.182 g·mol−1
Heat of Formation -68.6 ± 16.7 kJ·mol−1
Dipole Moment 2.21 ± 1.08 D
Volume 195.25 Å 3
Surface Area 184.53 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 3.29 ± eV
Point Group Symmetry C1
InChIKey BLKFEXKSMJLHDD-ZETCQYMHSA-N
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