Geometry & MOs

Info

ID:	19336
PubChem CID:	561920
Reduced:	SN2O2C22H28 (1)
Stoich.:	AB2C2D22E28 (1)
Weight, g/mol:	384.187149
ΔH_f, kcal/mol:	-69.67
Dipole, Da:	2.93
IP(EA), eV:	-8.94(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-anilino-3-benzylsulfanyl-1-oxopropan-2-yl)hexanamide

Drug info:

PubChemData

Smile

CCCCCC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC2=CC=CC=C2

DOS

IR

Vibrations