(+)-Etomidate

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Properties Simple | Detailed

Formula C14H16N2O2
IUPAC Name ethyl 3-[(1r)-1-phenylethyl]imidazol-3-ium-4-ylium-4-carboxylate
Molecular Mass 244.289 g·mol−1
Heat of Formation -166.3 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 304.56 Å 3
Surface Area 273.89 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -0.24 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(1r)-1-phenylethyl]-4-imidazolecarboxylic acid ethyl ester
  • 3-[(1r)-1-phenylethyl]imidazole-4-carboxylic acid ethyl ester
  • ethyl 3-[(1r)-1-phenylethyl]imidazole-4-carboxylate
  • r-16659
  • r16659
  • tocris-1471
InChIKey NPUKDXXFDDZOKR-LLVKDONJSA-N
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