(6S)-6-[4-(2-Methylphenyl)-1-Piperazinyl]-5,6,7,8-Tetrahydro-2-Naphthalenol

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Properties Simple | Detailed

Formula C21H26N2O
IUPAC Name (2s)-2-[4-(o-tolyl)piperazin-1-yl]tetralin-6-ol
Molecular Mass 322.444 g·mol−1
Heat of Formation -9.9 ± 16.7 kJ·mol−1
Dipole Moment 0.80 ± 1.08 D
Volume 406.16 Å 3
Surface Area 354.5 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy 0.15 ± eV
Point Group Symmetry C1
InChIKey ZYGBSDBJSDMKLV-IBGZPJMESA-N
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