Geometry & MOs

Info

ID:	275538
PubChem CID:	103816543
Reduced:	BrClN3O3H9C13 (1)
Stoich.:	ABC3D3E9F13 (1)
Weight, g/mol:	350.98547
ΔH_f, kcal/mol:	7.54
Dipole, Da:	0.94
IP(EA), eV:	-9.57(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-nitrophenyl)-1-methyl-2-oxopyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=C(N=C2)Cl)Br

DOS

IR

Vibrations