Geometry & MOs

Info

ID:	334562
PubChem CID:	127253237
Reduced:	NO3C10H10 (2)
Stoich.:	AB3C10D10 (2)
Weight, g/mol:	341.116427
ΔH_f, kcal/mol:	-181.1
Dipole, Da:	5.83
IP(EA), eV:	-9.02(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(1H-imidazol-5-yl)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CN1CCC2=C(C3=C(C(=C2C1=O)O)OCO3)CNC(=O)COC4=CC=CC=C4

DOS

IR

Vibrations