4-Carbamimidoylphenyl (2E)-3-(2-Methylphenyl)Acrylate

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Properties Simple | Detailed

Formula C17H16N2O2
IUPAC Name (4-carbamimidoylphenyl) (e)-3-(o-tolyl)prop-2-enoate
Molecular Mass 280.321 g·mol−1
Heat of Formation -26.2 ± 16.7 kJ·mol−1
Dipole Moment 3.11 ± 1.08 D
Volume 341.99 Å 3
Surface Area 321.97 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • (4-carbamimidoylphenyl) (e)-3-(2-methylphenyl)prop-2-enoate
  • (e)-3-(2-methylphenyl)acrylic acid (4-amidinophenyl) ester
  • (e)-3-(2-methylphenyl)prop-2-enoic acid (4-carbamimidoylphenyl) ester
InChIKey PSSASEIFCXYKEU-DHZHZOJOSA-N
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