Geometry & MOs

Info

ID:	282868
PubChem CID:	103942942
Reduced:	ON4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	8.06
Dipole, Da:	1.28
IP(EA), eV:	-9.15(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-aminobutan-2-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CCN)NC(=O)C1=C2C=CC=CN2N=C1

DOS

IR

Vibrations