(2R)-1-[(1,1,1,3,3,3-Hexafluoro-2-Propanyl)Oxy]-3-(2-Nitro-1H-Imidazol-1-Yl)-2-Propanol

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Properties Simple | Detailed

Formula C9H9F6N3O4
IUPAC Name (2r)-1-(2-nitro-4h-imidazol-1-ium-4-id-3-yl)-3-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]propan-2-ol
Molecular Mass 337.176 g·mol−1
Heat of Formation -1526.0 ± 16.7 kJ·mol−1
Dipole Moment 8.13 ± 1.08 D
Volume 318.9 Å 3
Surface Area 275.49 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy 1.90 ± eV
Point Group Symmetry C1
InChIKey RWMNREHJLVXWRN-RXMQYKEDSA-N
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