3-{2-[4-(4-Fluorophenyl)-1-Piperidinyl]Ethyl}-1,3-Benzothiazol-2(3H)-Imine

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Properties Simple | Detailed

Formula C20H22FN3S
IUPAC Name 3-[2-[4-(4-fluorophenyl)-1-piperidyl]ethyl]-1,3-benzothiazol-2-imine
Molecular Mass 355.472 g·mol−1
Heat of Formation 81.0 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 427.24 Å 3
Surface Area 369.99 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
InChIKey YIJMYOZUUPAERG-XDOYNYLZSA-N
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