(3β,11β,12R)-11,12-Epoxytrichothec-9-Ene-3,13-Diol

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Properties Simple | Detailed

Formula C15H22O4
IUPAC Name (3beta,11beta,12r)-11,12-epoxytrichothec-9-ene-3,13-diol
Molecular Mass 266.333 g·mol−1
Heat of Formation -734.1 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 315.02 Å 3
Surface Area 258.76 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 0.64 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 90044-33-0
InChIKey GFLMBFRNOPTZDK-CMBQYIQPSA-N
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