Geometry & MOs

Info

ID:	73453
PubChem CID:	48417749
Reduced:	SN3O4C17H21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	402.197714
ΔH_f, kcal/mol:	-122.71
Dipole, Da:	7.07
IP(EA), eV:	-8.81(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations