Geometry & MOs

Info

ID:	335108
PubChem CID:	127253914
Reduced:	N2O3C15H16 (2)
Stoich.:	A2B3C15D16 (2)
Weight, g/mol:	344.152478
ΔH_f, kcal/mol:	-96.99
Dipole, Da:	9.59
IP(EA), eV:	-8.69(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-pyrrolidin-1-ylethyl)indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNC(=O)[C@@H]2CC3=C(C=CC(=C3)[N+](=O)[O-])N4[C@H]2C5CC(C4)C6=CC=CC(=O)N6C5)OC

DOS

IR

Vibrations