Geometry & MOs

Info

ID:	180101
PubChem CID:	76577720
Reduced:	F3O3N5C29H30 (1)
Stoich.:	A3B3C5D29E30 (1)
Weight, g/mol:	438.045647
ΔH_f, kcal/mol:	-160.72
Dipole, Da:	6.9
IP(EA), eV:	-9.0(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-[[(1,1-dioxo-1-benzothiophen-6-yl)amino]methyl]imidazo[1,2-a]pyridin-6-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)C2=C3N=C(C(=C(N3N=C2)C(F)(F)F)C)C4=CC=C(C=C4)OC)CC(C5=CC=CC=C5)O

DOS

IR

Vibrations