3-Carboxylato-2,3-Dideoxy-D-Threo-Pentarate

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Properties Simple | Detailed

Formula C6H5O7---
IUPAC Name (1s,2r)-1-hydroxypropane-1,2,3-tricarboxylate
Molecular Mass 189.100 g·mol−1
Heat of Formation -782.5 ± 16.7 kJ·mol−1
Dipole Moment 1.61 ± 1.08 D
Volume 229.39 Å 3
Surface Area 220.79 Å 2
HOMO Energy -11.51 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
Synonyms
  • l-threo-isocitrate(3-)
InChIKey ODBLHEXUDAPZAU-FONMRSAGSA-K
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Elements C O