Geometry & MOs

Info

ID:	291452
PubChem CID:	112379020
Reduced:	N2O2C19H24 (1)
Stoich.:	A2B2C19D24 (1)
Weight, g/mol:	330.140199
ΔH_f, kcal/mol:	-53.34
Dipole, Da:	4.82
IP(EA), eV:	-8.7(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfanyl-N-(3-hydroxy-4-phenylbutan-2-yl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)CN(C)C2=CC=CC=C2

DOS

IR

Vibrations