Geometry & MOs

Info

ID:	287592
PubChem CID:	104247904
Reduced:	ON2C18H18 (1)
Stoich.:	AB2C18D18 (1)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	42.56
Dipole, Da:	5.11
IP(EA), eV:	-8.64(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,5-dimethylphenyl)-2-hydroxyethyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)N(C(=O)C=C2)CC3=CC=C(C=C3)C#CCN

DOS

IR

Vibrations