(1R,2S,6S,7S)-Hexahydro-1H-Pyrrolizine-1,2,6,7-Tetrol

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Formula C7H13NO4
IUPAC Name (1s,2r,6s,7r)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,6,7-tetrol
Molecular Mass 175.182 g·mol−1
Heat of Formation -743.3 ± 16.7 kJ·mol−1
Dipole Moment 4.08 ± 1.08 D
Volume 198.56 Å 3
Surface Area 186.97 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry Cs
Synonyms
  • (1alpha,2alpha,6alpha,7alpha,7aalpha)-hexahydro-1h-pyrrolizine-1,2,6,7-tetrol
  • (1r,2s,6r,7s)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,6,7-tetrol
  • (1r,2s,6r,7s)-pyrrolizidine-1,2,6,7-tetrol
  • 1,2,6,7-tetrahydroxypyrrolizidine
  • 1,2,6,7-thpz
  • 1h-pyrrolizine-1,2,6,7-tetrol, hexahydro-, (1alpha,2alpha,6alpha,7alpha,7aalpha)-
CAS Number(s)
  • 129415-27-6
InChIKey CXWWINPFWYPLRL-UJGWPWMASA-N
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