(3S,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Piperidinone

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Properties Simple | Detailed

Formula C6H11NO5
IUPAC Name (3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one
Molecular Mass 177.155 g·mol−1
Heat of Formation -939.9 ± 16.7 kJ·mol−1
Dipole Moment 0.43 ± 1.08 D
Volume 193.05 Å 3
Surface Area 181.03 Å 2
HOMO Energy -10.23 ± 0.55 eV
LUMO Energy 0.47 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-one
  • (3s,4s,5r,6r)-3,4,5-trihydroxy-6-methylol-2-piperidone
InChIKey AJJXPYDGVXIEHE-MBMOQRBOSA-N
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