Geometry & MOs

Info

ID:	171247
PubChem CID:	75349369
Reduced:	ClFNSO6H19C26 (1)
Stoich.:	ABCDE6F19G26 (1)
Weight, g/mol:	479.059422
ΔH_f, kcal/mol:	-196.29
Dipole, Da:	5.27
IP(EA), eV:	-8.92(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[3-[2-(4-chlorophenoxy)ethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenyl] benzoate

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CCOC3=CC=C(C=C3)Cl)OC(=O)C4=CC(=CC=C4)F

DOS

IR

Vibrations