4-[(2-Nitro-4H-Imidazol-1-Ium-4-Id-3-Yl)Methoxy]Butan-1-Ol

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Properties Simple | Detailed

Formula C8H13N3O4
IUPAC Name 4-[(2-nitro-4h-imidazol-1-ium-4-id-3-yl)methoxy]butan-1-ol
Molecular Mass 215.207 g·mol−1
Heat of Formation -233.1 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 250.42 Å 3
Surface Area 242.12 Å 2
HOMO Energy -10.28 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey DDDXPDINPPKUFN-UHFFFAOYSA-N
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