N-Benzyl-2-[(N-Benzyl-β-Alanyl)Amino]-4-Phenyl-3-Thiophenecarboxamide

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Formula C28H27N3O2S
IUPAC Name n-benzyl-2-[3-(benzylamino)propanoylamino]-4-phenyl-thiophene-3-carboxamide
Molecular Mass 469.598 g·mol−1
Heat of Formation 55.1 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 574.12 Å 3
Surface Area 499.98 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry C1
InChIKey WYXRECOQBJBCCU-UHFFFAOYSA-N
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