Geometry & MOs

Info

ID:	164667
PubChem CID:	74435396
Reduced:	NS2O3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	383.081385
ΔH_f, kcal/mol:	-82.94
Dipole, Da:	8.17
IP(EA), eV:	-9.24(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-5-[[4-(4-fluorophenyl)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CC(C)CC=C1C(=O)N(C(=S)S1)C(CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations