5-[(Allyl{2-[(4-Methoxybenzyl)Carbamoyl]Benzyl}Amino)Methyl]-1,3-Benzodioxole-4-Carboxylic Acid

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Formula C28H28N2O6
IUPAC Name 5-[[allyl-[[2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]methyl]amino]methyl]-1,3-benzodioxole-4-carboxylic acid
Molecular Mass 488.532 g·mol−1
Heat of Formation -638.7 ± 16.7 kJ·mol−1
Dipole Moment 2.47 ± 1.08 D
Volume 578.9 Å 3
Surface Area 415.56 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
InChIKey WRLIFDLBMCTVHJ-UHFFFAOYSA-N
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