(3R,4S)-3-[(S)-Hydroxy(Phenyl)Methyl]-4-[(1-Methyl-1H-Imidazol-5-Yl)Methyl]Dihydro-2(3H)-Furanone

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Formula C16H18N2O3
IUPAC Name (3r,4s)-3-[(s)-hydroxy(phenyl)methyl]-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one
Molecular Mass 286.326 g·mol−1
Heat of Formation -348.8 ± 16.7 kJ·mol−1
Dipole Moment 7.98 ± 1.08 D
Volume 340.63 Å 3
Surface Area 271.66 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s)-3-[(s)-hydroxy-phenyl-methyl]-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one
  • (3r,4s)-3-[(s)-hydroxy-phenyl-methyl]-4-[(3-methylimidazol-4-yl)methyl]tetrahydrofuran-2-one
  • (3r,4s)-3-[(s)-hydroxy-phenylmethyl]-4-[(3-methyl-4-imidazolyl)methyl]-2-tetrahydrofuranone
  • (3r,4s)-3-[(s)-hydroxy-phenylmethyl]-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one
  • oprea1_298616
InChIKey DZOVBAVEJYPSLL-BPLDGKMQSA-N
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