[(3S)-3-(4-Chlorophenyl)-3-(2-Pyridinyl)Propyl]Dimethylamine Oxide

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Properties Simple | Detailed

Formula C16H21ClN2O+
IUPAC Name (3s)-3-(4-chlorophenyl)-n,n-dimethyl-3-(3h-pyridin-1-ium-3-id-6-yl)propan-1-amine oxide
Molecular Mass 292.804 g·mol−1
Heat of Formation 148.3 ± 16.7 kJ·mol−1
Dipole Moment 7.77 ± 1.08 D
Volume 360.26 Å 3
Surface Area 313.62 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
InChIKey NMEICKDXQPVPKK-HNNXBMFYSA-N
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Elements H C N O Cl