1-(2-Deoxy-α-D-Erythro-Pentofuranosyl)-3-Nitro-1H-Pyrrole

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Formula C9H12N2O5
IUPAC Name (2s,3r,5s)-2-(hydroxymethyl)-5-(3-nitropyrrol-1-ium-3-ylium-1-yl)tetrahydrofuran-3-ol
Molecular Mass 228.202 g·mol−1
Heat of Formation -479.8 ± 16.7 kJ·mol−1
Dipole Moment 7.47 ± 1.08 D
Volume 253.06 Å 3
Surface Area 233.89 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
InChIKey WETFHJRYOTYZFD-VGMNWLOBSA-N
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