Geometry & MOs

Info

ID:	131328
PubChem CID:	51191317
Reduced:	BrSN2O3C14H15 (1)
Stoich.:	ABC2D3E14F15 (1)
Weight, g/mol:	387.086447
ΔH_f, kcal/mol:	-62.69
Dipole, Da:	4.71
IP(EA), eV:	-9.42(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-pyridin-3-ylethylsulfamoyl)-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)Br)OC

DOS

IR

Vibrations