Geometry & MOs

Info

ID:	132319
PubChem CID:	51342535
Reduced:	SN2O3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	438.161329
ΔH_f, kcal/mol:	-121.64
Dipole, Da:	3.96
IP(EA), eV:	-8.91(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(4-phenylmethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N(CC(=O)NC2CC3CCC2C3)S(=O)(=O)C

DOS

IR

Vibrations