Geometry & MOs

Info

ID:	178229
PubChem CID:	76298494
Reduced:	BrN3O3C18H18 (1)
Stoich.:	AB3C3D18E18 (1)
Weight, g/mol:	402.92961
ΔH_f, kcal/mol:	-67.64
Dipole, Da:	4.69
IP(EA), eV:	-9.56(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-oxopyridin-3-ylidene)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide

Drug info:

PubChemData

Smile

C1C(CNC(=O)C1NC(=O)C2=CC(=NC=C2)OCC3=CC=CC=C3)Br

DOS

IR

Vibrations