Geometry & MOs

Info

ID:	275664
PubChem CID:	103816970
Reduced:	BrNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	334.03169
ΔH_f, kcal/mol:	-124.21
Dipole, Da:	4.18
IP(EA), eV:	-8.98(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Br)NC(=O)COCCOC)C

DOS

IR

Vibrations