Geometry & MOs

Info

ID:	123651
PubChem CID:	50857886
Reduced:	FON2H17C19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	356.119464
ΔH_f, kcal/mol:	11.97
Dipole, Da:	3.98
IP(EA), eV:	-8.43(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[1-(4-methoxyphenyl)-5-methylpyrrol-3-yl]methylidene]-3-propyl-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CN1C2=CC=C(C=C2)OC)C=NC3=CC=CC=C3F

DOS

IR

Vibrations