3-[(2S)-2-Hydroxy-3-(2-Nitro-1H-Imidazol-1-Yl)Propyl]-1,3-Oxazolidin-2-One

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Properties Simple | Detailed

Formula C9H12N4O5
IUPAC Name 3-[(2s)-2-hydroxy-3-(2-nitroimidazol-1-ium-2-ylium-1-yl)propyl]oxazolidin-2-one
Molecular Mass 256.215 g·mol−1
Heat of Formation -363.8 ± 16.7 kJ·mol−1
Dipole Moment 1.37 ± 1.08 D
Volume 280.14 Å 3
Surface Area 254.27 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy 1.66 ± eV
Point Group Symmetry C1
InChIKey ATZLNNCRLCUSCS-SSDOTTSWSA-N
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