6-{[2-(4-Fluorophenyl)Ethyl][3-(~18~F)Fluoropropyl]Amino}-5,6,7,8-Tetrahydro-1-Naphthalenol

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Properties Simple | Detailed

Formula C21H25F2NO
IUPAC Name (2r)-2-[2-(4-fluorophenyl)ethyl-(3-fluoropropyl)amino]tetralin-5-ol
Molecular Mass 345.426 g·mol−1
Heat of Formation -478.2 ± 16.7 kJ·mol−1
Dipole Moment 0.77 ± 1.08 D
Volume 432.57 Å 3
Surface Area 373.83 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey PBHVQBRNEVYHGT-LJQANCHMSA-N
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