Geometry & MOs

Info

ID:	20118
PubChem CID:	579563
Reduced:	ON3C13H13 (1)
Stoich.:	AB3C13D13 (1)
Weight, g/mol:	227.105862
ΔH_f, kcal/mol:	14.6
Dipole, Da:	7.28
IP(EA), eV:	-8.73(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-3-(pyridin-3-ylmethylideneamino)-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=O)N1)N=CC2=CN=CC=C2)C

DOS

IR

Vibrations