Geometry & MOs

Info

ID:	60479
PubChem CID:	26697069
Reduced:	BrSN3O4C20H24 (1)
Stoich.:	ABC3D4E20F24 (1)
Weight, g/mol:	394.089523
ΔH_f, kcal/mol:	-120.83
Dipole, Da:	7.27
IP(EA), eV:	-8.98(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-(2-morpholin-4-ylethyl)-4-(thiophen-2-ylsulfonylamino)benzenecarboximidate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCN3CCOCC3

DOS

IR

Vibrations