Geometry & MOs

Info

ID:	143947
PubChem CID:	53285796
Reduced:	SN2O4C23H30 (1)
Stoich.:	AB2C4D23E30 (1)
Weight, g/mol:	404.176979
ΔH_f, kcal/mol:	-141.86
Dipole, Da:	1.84
IP(EA), eV:	-8.81(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethyl-N-methylsulfonylanilino)-N-[(4-methoxyphenyl)methyl]butanamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

DOS

IR

Vibrations