Geometry & MOs

Info

ID:	396992
PubChem CID:	135029557
Reduced:	ON5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	227.131014
ΔH_f, kcal/mol:	80.58
Dipole, Da:	7.91
IP(EA), eV:	-9.02(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethenyl-1,2,3,6,7,11b-hexahydrobenzo[a]quinolizin-4-one

Drug info:

PubChemData

Smile

CC1(CCN2C=NC3=C2C(=NC=N3)N1O)C=C4CCC4

DOS

IR

Vibrations