(1S)-1-(3,4-Dimethoxyphenyl)-2-{[(2E)-3-Phenyl-2-Propenoyl]Amino}Ethyl (2E)-3-Phenylacrylate

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Properties Simple | Detailed

Formula C28H27NO5
IUPAC Name [(1s)-1-(3,4-dimethoxyphenyl)-2-[[(e)-3-phenylprop-2-enoyl]amino]ethyl] (e)-3-phenylprop-2-enoate
Molecular Mass 457.518 g·mol−1
Heat of Formation -455.4 ± 16.7 kJ·mol−1
Dipole Moment 3.14 ± 1.08 D
Volume 561.49 Å 3
Surface Area 445.62 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-phenylacrylic acid [(1s)-1-(3,4-dimethoxyphenyl)-2-[[(e)-3-phenylacryloyl]amino]ethyl] ester
  • (e)-3-phenylprop-2-enoic acid [(1s)-1-(3,4-dimethoxyphenyl)-2-[[(e)-1-oxo-3-phenylprop-2-enyl]amino]ethyl] ester
  • [(1s)-1-(3,4-dimethoxyphenyl)-2-[[(e)-3-phenylprop-2-enoyl]amino]ethyl] (e)-3-phenylprop-2-enoate
InChIKey CUXXAUBWEIJETF-AMVLLGRPSA-N
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