N-[(1S,2R,5R,6R)-2-Amino-5,6-Dihydroxy-4-(Hydroxymethyl)-3-Cyclohexen-1-Yl]Acetamide

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Formula C9H16N2O4
IUPAC Name n-[(1s,2r,5r,6r)-2-amino-5,6-dihydroxy-4-(hydroxymethyl)cyclohex-3-en-1-yl]acetamide
Molecular Mass 216.234 g·mol−1
Heat of Formation -722.3 ± 16.7 kJ·mol−1
Dipole Moment 5.29 ± 1.08 D
Volume 252.51 Å 3
Surface Area 233.9 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 0.18 ± eV
Point Group Symmetry C1
Synonyms
  • beu
  • n-[(1s,2r,5r,6r)-2-amino-5,6-dihydroxy-4-(hydroxymethyl)-1-cyclohex-3-enyl]acetamide
  • n-[(1s,2r,5r,6r)-2-amino-5,6-dihydroxy-4-(hydroxymethyl)-1-cyclohex-3-enyl]ethanamide
  • n-[(1s,2r,5r,6r)-2-amino-5,6-dihydroxy-4-methylol-1-cyclohex-3-enyl]acetamide
InChIKey WWUMIYBLWZAJTD-BZNPZCIMSA-N
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