(2S)-2-Chloro-3-(1H-Imidazol-4-Yl)Propanoic Acid

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Properties Simple | Detailed

Formula C6H7ClN2O2
IUPAC Name (2s)-2-chloro-3-imidazol-3-ium-4-ylium-4-yl-propanoic acid
Molecular Mass 174.585 g·mol−1
Heat of Formation -321.7 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 186.57 Å 3
Surface Area 183.94 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
InChIKey JZLQYMHAXPPICX-YFKPBYRVSA-N
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Elements H C N O Cl