Methyl 2-Chloro-3-(1H-Imidazol-5-Yl)Propanoate

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Properties Simple | Detailed

Formula C7H9ClN2O2
IUPAC Name methyl (2r)-2-chloro-3-imidazol-3-ium-4-ylium-4-yl-propanoate
Molecular Mass 188.612 g·mol−1
Heat of Formation -286.4 ± 16.7 kJ·mol−1
Dipole Moment 6.38 ± 1.08 D
Volume 210.88 Å 3
Surface Area 205.7 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
InChIKey JIPJJONLBKXGDE-ZCFIWIBFSA-N
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Elements H C N O Cl