Geometry & MOs

Info

ID:	269700
PubChem CID:	103618680
Reduced:	BrNO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	334.03169
ΔH_f, kcal/mol:	-50.96
Dipole, Da:	4.44
IP(EA), eV:	-9.3(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2,6-dimethylphenyl)-1-methyl-2-oxopyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1NC(=O)C(C2=CC=CC=C2)O)C)Br

DOS

IR

Vibrations