(2S)-3-(2-Nitro-4H-Imidazol-1-Ium-4-Id-3-Yl)Propane-1,2-Diol

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Properties Simple | Detailed

Formula C6H10N3O4
IUPAC Name (2s)-3-(2-nitro-4h-imidazol-1-ium-4-id-3-yl)propane-1,2-diol
Molecular Mass 188.161 g·mol−1
Heat of Formation -227.8 ± 16.7 kJ·mol−1
Dipole Moment 5.51 ± 1.08 D
Volume 207.34 Å 3
Surface Area 198.53 Å 2
HOMO Energy -10.45 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
InChIKey TUVKHNYOBWYTAL-YFKPBYRVSA-N
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