Geometry & MOs

Info

ID:	303742
PubChem CID:	124490122
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-37.06
Dipole, Da:	1.65
IP(EA), eV:	-8.64(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[(3R)-1-methylpiperidin-3-yl]-1-phenylethanol

Drug info:

PubChemData

Smile

C[C@H]1[C@](CCCN1C)(C2=CC=CC=C2)O

DOS

IR

Vibrations