Geometry & MOs

Info

ID:	208162
PubChem CID:	80501734
Reduced:	BrO2N3C10H14 (1)
Stoich.:	AB2C3D10E14 (1)
Weight, g/mol:	283.9619
ΔH_f, kcal/mol:	-63.61
Dipole, Da:	1.44
IP(EA), eV:	-8.56(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-3-bromo-1-(thiophen-3-ylmethyl)pyridin-2-one

Drug info:

PubChemData

Smile

CCN(C)C(=O)CN1C=C(C=C(C1=O)Br)N

DOS

IR

Vibrations