(3S)-6-(2-Carboxyethyl)-8-Hydroxy-5-Oxo-1,2,3,5-Tetrahydro-3-Indolizinecarboxylic Acid

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Properties Simple | Detailed

Formula C12H13NO6
IUPAC Name (3s)-6-(2-carboxyethyl)-8-hydroxy-5-oxo-2,3-dihydro-1h-indolizine-3-carboxylic acid
Molecular Mass 267.235 g·mol−1
Heat of Formation -1050.6 ± 16.7 kJ·mol−1
Dipole Moment 6.38 ± 1.08 D
Volume 296.77 Å 3
Surface Area 270.81 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-6-(2-carboxyethyl)-8-hydroxy-5-keto-2,3-dihydro-1h-indolizine-3-carboxylic acid
InChIKey HMWIHWAAIYAMFZ-QMMMGPOBSA-N
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