Geometry & MOs

Info

ID:	303056
PubChem CID:	124489157
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-50.94
Dipole, Da:	3.09
IP(EA), eV:	-8.07(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[4-[(3R)-3-methylpiperidin-1-yl]phenyl]ethanol

Drug info:

PubChemData

Smile

C[C@H]1CCCCN1C2=CC=C(C=C2)[C@H](C)O

DOS

IR

Vibrations