3-[(3R,4R)-1-(3-Hydroxy-3-Phenylpropyl)-3,4-Dimethyl-4-Piperidinyl]Phenol

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Properties Simple | Detailed

Formula C22H29NO2
IUPAC Name 3-[(1r,3s,4s)-1-[(3s)-3-hydroxy-3-phenyl-propyl]-3,4-dimethyl-4-piperidyl]phenol
Molecular Mass 339.471 g·mol−1
Heat of Formation -271.6 ± 16.7 kJ·mol−1
Dipole Moment 3.12 ± 1.08 D
Volume 442.85 Å 3
Surface Area 359.32 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
InChIKey YJQIKSUIZIHGOJ-WTNAPCKOSA-N
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