Geometry & MOs

Info

ID:	381006
PubChem CID:	134971629
Reduced:	NO3H21C23 (1)
Stoich.:	AB3C21D23 (1)
Weight, g/mol:	359.152144
ΔH_f, kcal/mol:	-41.59
Dipole, Da:	6.06
IP(EA), eV:	-8.84(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-dimethoxy-1,2-diphenyl-1,4-dihydroisoquinolin-3-one

Drug info:

PubChemData

Smile

COC1=C2CC(=O)NC(C2=C(C=C1)OC)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations