2-Dichloroacetamido-1-(2-Benzofuranyl)Propane-1,3-Diol

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Properties Simple | Detailed

Formula C13H13Cl2NO4
IUPAC Name n-[(1r,2s)-2-(benzofuran-2-yl)-2-hydroxy-1-(hydroxymethyl)ethyl]-2,2-dichloro-acetamide
Molecular Mass 318.153 g·mol−1
Heat of Formation -595.4 ± 16.7 kJ·mol−1
Dipole Moment 3.65 ± 1.08 D
Volume 339.84 Å 3
Surface Area 304.44 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 2.27 ± eV
Point Group Symmetry C1
InChIKey FXNSMHZTLITRNN-KCJUWKMLSA-N
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Elements H C N O Cl