Geometry & MOs

Info

ID:	402906
PubChem CID:	135057805
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	433.167794
ΔH_f, kcal/mol:	-157.42
Dipole, Da:	2.72
IP(EA), eV:	-8.6(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-bis(4-methoxyphenyl)-2-phenylisoquinolin-1-one

Drug info:

PubChemData

Smile

CCCC1=C(C2=C(O1)C=C(C=C2)O)CC(=O)OCC

DOS

IR

Vibrations