1-{3-[(5-Chloro-2-Ethoxy-3-Iodobenzyl)Amino]Propyl}-3-(3-Thienyl)Urea

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Properties Simple | Detailed

Formula C17H21ClIN3O2S
IUPAC Name 1-[3-[(5-chloro-2-ethoxy-3-iodo-phenyl)methylamino]propyl]-3-(3-thienyl)urea
Molecular Mass 493.790 g·mol−1
Heat of Formation -114.5 ± 16.7 kJ·mol−1
Dipole Moment 1.48 ± 1.08 D
Volume 477.03 Å 3
Surface Area 423.23 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
InChIKey FFSZNPGAUXCRFJ-UHFFFAOYSA-N
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