(2S,3S,4R,5R)-2-(4-Aminophenyl)-5-(Hydroxymethyl)-3,4-Pyrrolidinediol

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Formula C11H16N2O3
IUPAC Name (2s,3s,4r,5r)-2-(4-aminophenyl)-5-(hydroxymethyl)pyrrolidine-3,4-diol
Molecular Mass 224.256 g·mol−1
Heat of Formation -469.0 ± 16.7 kJ·mol−1
Dipole Moment 3.05 ± 1.08 D
Volume 267.18 Å 3
Surface Area 241.76 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 3.23 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r,5r)-2-(4-aminophenyl)-5-(hydroxymethyl)pyrrolidine-3,4-diol
  • (2s,3s,4r,5r)-2-(4-aminophenyl)-5-methylol-pyrrolidine-3,4-diol
  • 2-(4-amino-phenyl)-5-hydroxymethyl-pyrrolidine-3,4-diol
  • pir
InChIKey SQENVZNKXLCDLF-YTWAJWBKSA-N
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