Geometry & MOs

Info

ID:	187026
PubChem CID:	77520006
Reduced:	ON3C18H27 (1)
Stoich.:	AB3C18D27 (1)
Weight, g/mol:	137.047678
ΔH_f, kcal/mol:	-47.27
Dipole, Da:	2.01
IP(EA), eV:	-9.29(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-3H-pyridin-4-one

Drug info:

PubChemData

Smile

CC1CC(C2C(C1)CC(C(=O)N2)CNCC3=CN=CC=C3)C

DOS

IR

Vibrations