Geometry & MOs

Info

ID:	436712
PubChem CID:	135208011
Reduced:	S2N3O4H13C18 (1)
Stoich.:	A2B3C4D13E18 (1)
Weight, g/mol:	435.034748
ΔH_f, kcal/mol:	-21.62
Dipole, Da:	5.92
IP(EA), eV:	-9.07(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]oxymethylidene]-3-phenyl-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C=CCN1C(=O)/C(=C\OC2=CC=C(O2)SC3=NC4=CC=CC=C4N3)/SC1=O

DOS

IR

Vibrations