Geometry & MOs

Info

ID:	303740
PubChem CID:	124490118
Reduced:	O3C19H22 (1)
Stoich.:	A3B19C22 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-31.76
Dipole, Da:	2.03
IP(EA), eV:	-9.02(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-1,2-dimethyl-3-phenylpiperidin-3-ol

Drug info:

PubChemData

Smile

C[C@]12C[C@H]3[C@]4(O3)[C@@H]([C@@H]1CCC2=O)CCC5=CC(=O)C=C[C@@]45C

DOS

IR

Vibrations