Geometry & MOs

Info

ID:	334882
PubChem CID:	127253688
Reduced:	ClSN2O7C23H29 (1)
Stoich.:	ABC2D7E23F29 (1)
Weight, g/mol:	441.157623
ΔH_f, kcal/mol:	-265.43
Dipole, Da:	9.13
IP(EA), eV:	-8.75(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-[2-(4-methoxyphenyl)ethyl]indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)NC2=CC(=O)[C@@]3([C@@H](C2)C)C(=O)C4=C(O3)C(=C(C=C4OC)OC)Cl

DOS

IR

Vibrations