Geometry & MOs

Info

ID:	73460
PubChem CID:	48417776
Reduced:	SN2O3C20H26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	406.138485
ΔH_f, kcal/mol:	-110.17
Dipole, Da:	3.38
IP(EA), eV:	-8.77(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methylphenyl)methylsulfanyl]-N-[2-methyl-3-(propylsulfonylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=CC(=C1C)NC(=O)C2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations