2-Nitro-1-Pentofuranosyl-1H-Imidazole

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Formula C8H12N3O6
IUPAC Name (2r,3s,4r,5s)-2-(hydroxymethyl)-5-(2-nitro-4h-imidazol-1-ium-4-id-3-yl)tetrahydrofuran-3,4-diol
Molecular Mass 246.197 g·mol−1
Heat of Formation -562.5 ± 16.7 kJ·mol−1
Dipole Moment 5.51 ± 1.08 D
Volume 257.73 Å 3
Surface Area 231.16 Å 2
HOMO Energy -10.21 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
InChIKey GEPYEWPQCQPUJN-VZFHVOOUSA-N
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