Geometry & MOs

Info

ID:	23801
PubChem CID:	606117
Reduced:	NO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	269.141579
ΔH_f, kcal/mol:	-41.9
Dipole, Da:	8.62
IP(EA), eV:	-8.61(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-acetyl-1-ethyl-4-phenyl-4H-pyridin-3-yl)ethanone

Drug info:

PubChemData

Smile

CCN1C=C(C(C(=C1)C(=O)C)C2=CC=CC=C2)C(=O)C

DOS

IR

Vibrations