1-(2-Ethylsulfonylethyl)-2-Methyl-5-Nitro-Imidazol-3-Ium-5-Ide

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Properties Simple | Detailed

Formula C8H14N3O4S
IUPAC Name 1-(2-ethylsulfonylethyl)-2-methyl-5-nitro-imidazol-3-ium-5-ide
Molecular Mass 248.280 g·mol−1
Heat of Formation -288.1 ± 16.7 kJ·mol−1
Dipole Moment 2.24 ± 1.08 D
Volume 271.24 Å 3
Surface Area 244.3 Å 2
HOMO Energy -10.15 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey CPIHNCLBNSXAQP-UHFFFAOYSA-N
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