1-Methoxy-3-(2-Methyl-4-Nitro-1H-Imidazol-1-Yl)-2-Propanol

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Properties Simple | Detailed

Formula C8H13N3O4
IUPAC Name (2s)-1-methoxy-3-(2-methyl-4-nitro-imidazol-1-yl)propan-2-ol
Molecular Mass 215.207 g·mol−1
Heat of Formation -267.7 ± 16.7 kJ·mol−1
Dipole Moment 10.82 ± 1.08 D
Volume 250.5 Å 3
Surface Area 241.6 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry C1
InChIKey JXMRDOOWRDWKJG-ZETCQYMHSA-N
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