(3S,4R)-1-[2-(Dimethylamino)Ethyl]-4-(4-Methoxyphenyl)-3-Methyl-6-(Trifluoromethyl)-1,3,4,5-Tetrahydro-2H-1-Benzazepin-2-One

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Formula C23H27F3N2O2
IUPAC Name (3s,4s)-1-[2-(dimethylamino)ethyl]-4-(4-methoxyphenyl)-3-methyl-6-(trifluoromethyl)-4,5-dihydro-3h-1-benzazepin-2-one
Molecular Mass 420.468 g·mol−1
Heat of Formation -862.0 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 492.87 Å 3
Surface Area 407.17 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
InChIKey ZBCRNIFALVNVKY-YJBOKZPZSA-N
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