Geometry & MOs

Info

ID:	335152
PubChem CID:	127254013
Reduced:	ClSN4O5H19C23 (1)
Stoich.:	ABC4D5E19F23 (1)
Weight, g/mol:	390.136828
ΔH_f, kcal/mol:	-69.15
Dipole, Da:	0.72
IP(EA), eV:	-8.89(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(1H-indol-3-yl)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

C[C@@H]1CC2=C(C(N3C=NNC3=N2)C4=CSC=C4)C(=O)[C@]15C(=O)C6=C(O5)C(=C(C=C6OC)OC)Cl

DOS

IR

Vibrations