Geometry & MOs

Info

ID:	1477
PubChem CID:	4567
Reduced:	NO2C19H25 (1)
Stoich.:	AB2C19D25 (1)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	-66.72
Dipole, Da:	2.39
IP(EA), eV:	-9.04(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-hydroxy-2-(4-phenylbutan-2-ylamino)propyl]phenol

Drug info:

PubChemData

Smile

CC(CCC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O

DOS

IR

Vibrations