Geometry & MOs

Info

ID:	171342
PubChem CID:	75364007
Reduced:	ON5C11H13 (1)
Stoich.:	AB5C11D13 (1)
Weight, g/mol:	333.024184
ΔH_f, kcal/mol:	96.74
Dipole, Da:	6.62
IP(EA), eV:	-9.47(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCO/N=C(/C)\C1=CC=C(C=C1)N2C=NN=N2

DOS

IR

Vibrations