Geometry & MOs

Info

ID:	140930
PubChem CID:	52785912
Reduced:	ClNSO3F4C11H12 (1)
Stoich.:	ABCD3E4F11G12 (1)
Weight, g/mol:	399.013061
ΔH_f, kcal/mol:	-316.65
Dipole, Da:	4.06
IP(EA), eV:	-9.97(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-methoxyethyl)-N-(2,2,2-trifluoroethyl)-2-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

COCCN(CC(F)(F)F)S(=O)(=O)C1=C(C=C(C=C1)Cl)F

DOS

IR

Vibrations