Geometry & MOs

Info

ID:	28937
PubChem CID:	830795
Reduced:	ON5H15C19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	116.1
Dipole, Da:	2.76
IP(EA), eV:	-9.14(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-acetyl-2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridin-3-yl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NN=CC2=CC=CC=N2)N=CC3=CC=CC=N3

DOS

IR

Vibrations