Geometry & MOs

Info

ID:	335111
PubChem CID:	127253917
Reduced:	ClNO5C24H24 (1)
Stoich.:	ABC5D24E24 (1)
Weight, g/mol:	406.152872
ΔH_f, kcal/mol:	-151.08
Dipole, Da:	4.53
IP(EA), eV:	-8.84(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxy-5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

C[C@@H]1CC(=CC(=O)[C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)NCCC4=CC=CC=C4

DOS

IR

Vibrations