(+)-Australine

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Formula C8H15NO4
IUPAC Name (1r,2r,3r,4s,7s,8r)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,7-triol
Molecular Mass 189.209 g·mol−1
Heat of Formation -777.8 ± 16.7 kJ·mol−1
Dipole Moment 4.50 ± 1.08 D
Volume 220.58 Å 3
Surface Area 198.72 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 1.73 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,3r,7s,8r)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,7-triol
  • (1r,2r,3r,7s,8r)-3-methylolpyrrolizidine-1,2,7-triol
  • 186766-07-4 (hcl)
  • 7.alpha.-epialexine
  • australine
  • smp2_000198
CAS Number(s)
  • 118396-02-4
InChIKey AIQMLBKBQCVDEY-OZRXBMAMSA-N
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