Geometry & MOs

Info

ID:	167143
PubChem CID:	74786007
Reduced:	O3N4C30H32 (1)
Stoich.:	A3B4C30D32 (1)
Weight, g/mol:	396.060235
ΔH_f, kcal/mol:	-42.09
Dipole, Da:	6.38
IP(EA), eV:	-8.53(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-5-(thiophen-2-ylmethylidene)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NC=C2CN(CCC2=C1CNC(=O)C=CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)N5CCOCC5

DOS

IR

Vibrations