(3R,4S,5R)-5-[(1-Carboxylatovinyl)Oxy]-4-Hydroxy-3-(Phosphonatooxy)-1-Cyclohexene-1-Carboxylate

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Properties Simple | Detailed

Formula C10H13O10P
IUPAC Name (3r,4s,5s)-5-(1-carboxyvinyloxy)-4-hydroxy-3-phosphonooxy-cyclohexene-1-carboxylic acid
Molecular Mass 324.178 g·mol−1
Heat of Formation -1978.3 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 333.11 Å 3
Surface Area 301.54 Å 2
HOMO Energy -10.10 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey QUTYKIXIUDQOLK-RNJXMRFFSA-N
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