Geometry & MOs

Info

ID:	134032
PubChem CID:	51627884
Reduced:	ClON2C21H27 (1)
Stoich.:	ABC2D21E27 (1)
Weight, g/mol:	204.162649
ΔH_f, kcal/mol:	-9.34
Dipole, Da:	1.86
IP(EA), eV:	-8.69(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-3-phenylpiperidin-1-yl]ethanamine

Drug info:

PubChemData

Smile

CCN1CCC[C@@H]1CNCC2=CC=CC=C2OCC3=CC=CC=C3Cl

DOS

IR

Vibrations