(2S,4R,5R)-5-Hydroxy-4-(Sulfooxy)-2-Piperidinecarboxylic Acid

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Properties Simple | Detailed

Formula C6H11NO7S
IUPAC Name (2s,4r,5r)-5-hydroxy-4-sulfooxy-piperidine-2-carboxylic acid
Molecular Mass 241.219 g·mol−1
Heat of Formation -1272.8 ± 16.7 kJ·mol−1
Dipole Moment 2.45 ± 1.08 D
Volume 241.93 Å 3
Surface Area 222.44 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4r,5r)-5-hydroxy-4-sulfooxy-2-piperidinecarboxylic acid
  • (2s,4r,5r)-5-hydroxy-4-sulfooxy-piperidine-2-carboxylic acid
  • (2s,4r,5r)-5-hydroxy-4-sulfooxypiperidine-2-carboxylic acid
  • (2s,4r,5r)-5-hydroxy-4-sulfoxy-pipecolinic acid
InChIKey VGWGHJSLZPTLLA-VPENINKCSA-N
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