1-{2-[4-(3-{4-[2-(1-Pyrrolidinyl)Ethoxy]Benzyl}-1-Benzothiophen-2-Yl)Phenoxy]Ethyl}Pyrrolidine

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Formula C33H38N2O2S
IUPAC Name 1-[2-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]methyl]phenoxy]ethyl]pyrrolidine
Molecular Mass 526.732 g·mol−1
Heat of Formation -27.9 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 661.47 Å 3
Surface Area 563.1 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[2-[4-[[2-[4-(2-1-pyrrolidinylethoxy)phenyl]-3-benzothiophenyl]methyl]phenoxy]ethyl]pyrrolidine
  • 1-[2-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methyl]phenoxy]ethyl]pyrrolidine
  • 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophene
  • bt2
InChIKey MBVYSLWWSSHIRS-UHFFFAOYSA-N
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