Geometry & MOs

Info

ID:	334652
PubChem CID:	127253327
Reduced:	O2N3C23H39 (1)
Stoich.:	A2B3C23D39 (1)
Weight, g/mol:	508.236208
ΔH_f, kcal/mol:	-104.22
Dipole, Da:	5.04
IP(EA), eV:	-8.11(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(1-benzylpiperidin-4-yl)ethyl]-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CC1=CC=C(N1CCC(=O)N(CCCOC)C[C@@H]2CCCN3[C@@H]2CCCC3)C

DOS

IR

Vibrations