Geometry & MOs

Info

ID:	216095
PubChem CID:	85085701
Reduced:	OC15H28 (1)
Stoich.:	AB15C28 (1)
Weight, g/mol:	225.078979
ΔH_f, kcal/mol:	-76.67
Dipole, Da:	1.93
IP(EA), eV:	-9.07(1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-10bH-benzo[h]isoquinolin-1-one

Drug info:

PubChemData

Smile

CCC=C(CC)C(CC)(C(=CCC)CC)O

DOS

IR

Vibrations