Geometry & MOs

Info

ID:	77076
PubChem CID:	48425777
Reduced:	SO2N3C17H21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	343.05315
ΔH_f, kcal/mol:	-48.06
Dipole, Da:	3.41
IP(EA), eV:	-9.12(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(5-bromo-2-oxopyridin-1-yl)acetyl]amino]-N,N-diethylacetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=CSC(=N1)C2=CC=CC=C2

DOS

IR

Vibrations