Geometry & MOs

Info

ID:	208148
PubChem CID:	80501720
Reduced:	BrOF2N2H9C12 (1)
Stoich.:	ABC2D2E9F12 (1)
Weight, g/mol:	287.02694
ΔH_f, kcal/mol:	-80.07
Dipole, Da:	3.05
IP(EA), eV:	-8.6(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-amino-3-bromo-2-oxopyridin-1-yl)-N,N-dimethylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)F)CN2C=C(C=C(C2=O)Br)N

DOS

IR

Vibrations