Geometry & MOs

Info

ID:	216758
PubChem CID:	85086730
Reduced:	NO2C19H25 (1)
Stoich.:	AB2C19D25 (1)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	-48.35
Dipole, Da:	0.48
IP(EA), eV:	-8.9(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,14-dimethyl-3-azapentacyclo[9.7.0.02,4.05,10.014,18]octadec-5-ene-7,15-dione

Drug info:

PubChemData

Smile

CC(=O)OCC=CC=CC=CCCCCCC1=CN=CC=C1

DOS

IR

Vibrations