Geometry & MOs

Info

ID:	205447
PubChem CID:	80102663
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	269.177964
ΔH_f, kcal/mol:	-7.8
Dipole, Da:	2.95
IP(EA), eV:	-8.88(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-methylphenyl)-2-(propylamino)ethyl]phenol

Drug info:

PubChemData

Smile

CCNC(CC1=CC(=CC=C1)O)CC2=CC=CC=N2

DOS

IR

Vibrations