Geometry & MOs

Info

ID:	334399
PubChem CID:	127252951
Reduced:	O9H26C29 (1)
Stoich.:	A9B26C29 (1)
Weight, g/mol:	523.210721
ΔH_f, kcal/mol:	-242.78
Dipole, Da:	6.6
IP(EA), eV:	-8.55(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[3-oxo-3-(2-pyridin-3-ylpiperidin-1-yl)propyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C4=C(C=C3)OC(=O)CC4C5=C(C(=C(C=C5)OC)OC)OC)OC

DOS

IR

Vibrations