Geometry & MOs

Info

ID:	291517
PubChem CID:	113137184
Reduced:	SN2F3O3C14H19 (1)
Stoich.:	AB2C3D3E14F19 (1)
Weight, g/mol:	380.096141
ΔH_f, kcal/mol:	-260.95
Dipole, Da:	7.84
IP(EA), eV:	-9.29(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-3-(2,3-dimethyl-N-methylsulfonylanilino)propanamide

Drug info:

PubChemData

Smile

CCC(C)N(CCC(=O)NC1=C(C(=C(C=C1)F)F)F)S(=O)(=O)C

DOS

IR

Vibrations