Geometry & MOs

Info

ID:	172904
PubChem CID:	75570167
Reduced:	FNSO3H16C23 (1)
Stoich.:	ABCD3E16F23 (1)
Weight, g/mol:	407.021677
ΔH_f, kcal/mol:	-69.93
Dipole, Da:	3.7
IP(EA), eV:	-9.19(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3OCC4=CC=CC=C4F)SC2=O

DOS

IR

Vibrations