(2R,3R,6R)-2-(Hydroxymethyl)-6-(2-Nitro-4H-Imidazol-1-Ium-4-Id-3-Yl)-3,6-Dihydro-2H-Pyran-3-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C9H12N3O5
IUPAC Name (2r,3r,6r)-2-(hydroxymethyl)-6-(2-nitro-4h-imidazol-1-ium-4-id-3-yl)-3,6-dihydro-2h-pyran-3-ol
Molecular Mass 242.209 g·mol−1
Heat of Formation -307.1 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 259.6 Å 3
Surface Area 235.77 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
InChIKey MLYXYTFXGQXVTK-BWZBUEFSSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N