Geometry & MOs

Info

ID:	131326
PubChem CID:	51191199
Reduced:	NSO4C16H23 (1)
Stoich.:	ABC4D16E23 (1)
Weight, g/mol:	364.026011
ΔH_f, kcal/mol:	-167.51
Dipole, Da:	6.9
IP(EA), eV:	-9.57(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(1-pyridin-3-ylethyl)-2-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C(C)OC2=CC=C(C=C2)S(=O)(=O)C

DOS

IR

Vibrations