1-{3-[(3-Ethynylbenzyl)Amino]Propyl}-3-(3-Thienyl)Urea

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Formula C17H19N3OS
IUPAC Name 1-[3-[(3-ethynylphenyl)methylamino]propyl]-3-(3-thienyl)urea
Molecular Mass 313.417 g·mol−1
Heat of Formation 273.8 ± 16.7 kJ·mol−1
Dipole Moment 2.81 ± 1.08 D
Volume 387.05 Å 3
Surface Area 369.48 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy 2.63 ± eV
Point Group Symmetry C1
InChIKey NIXVRUOYNFTKQD-UHFFFAOYSA-N
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