(1R,2S,3R,4R,5S,6S)-7-Azabicyclo[4.1.0]Heptane-2,3,4,5-Tetrol

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Formula C6H11NO4
IUPAC Name (1s,2s,3r,4r,5s,6r)-7-azabicyclo[4.1.0]heptane-2,3,4,5-tetrol
Molecular Mass 161.156 g·mol−1
Heat of Formation -625.2 ± 16.7 kJ·mol−1
Dipole Moment 2.01 ± 1.08 D
Volume 180.0 Å 3
Surface Area 172.71 Å 2
HOMO Energy -10.48 ± 0.55 eV
LUMO Energy 1.48 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,2s,3r,4r,5s,6r)-7-azabicyclo[4.1.0]heptane-2,3,4,5-tetrol
  • 1,2-dideoxy-1,2-epimino-myo-inositol
  • 1,2-dideoxy-1,2-iminoinositol
  • 7-azabicyclo(4.1.0)heptane-2,3,4,5-tetrol, (1alpha,2alpha,3beta,4alpha,5beta,6alpha)-
  • conduritol aziridine
CAS Number(s)
  • 123788-61-4
InChIKey UVCVKSCVWUWBRS-UZAAGFTCSA-N
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