Geometry & MOs

Info

ID:	334585
PubChem CID:	127253260
Reduced:	ClNO5H18C19 (1)
Stoich.:	ABC5D18E19 (1)
Weight, g/mol:	531.334859
ΔH_f, kcal/mol:	-120.16
Dipole, Da:	4.2
IP(EA), eV:	-8.85(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hexadecyl-3,4-dimethoxyindeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations