1-[(2S,3R)-2-Hydroxy-3-Nonanyl]-1H-Imidazole-4-Carboxamide

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Properties Simple | Detailed

Formula C13H23N3O2
IUPAC Name 3-[(1r)-1-[(1r)-1-hydroxyethyl]heptyl]-4h-imidazol-3-ium-4-ylium-5-carboxamide
Molecular Mass 253.341 g·mol−1
Heat of Formation -410.5 ± 16.7 kJ·mol−1
Dipole Moment 7.19 ± 1.08 D
Volume 336.8 Å 3
Surface Area 312.1 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 0.30 ± eV
Point Group Symmetry C1
InChIKey JWHINRCANJWPCL-ZYHUDNBSSA-N
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