Geometry & MOs

Info

ID:	195140
PubChem CID:	78642603
Reduced:	ClF3O5H12C17 (1)
Stoich.:	AB3C5D12E17 (1)
Weight, g/mol:	370.098728
ΔH_f, kcal/mol:	-302.74
Dipole, Da:	3.31
IP(EA), eV:	-10.03(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-2-[4-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,3-thiazolidin-5-yl]acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(O1)COC(=O)C=CC2=CC(=C(C=C2)Cl)C(F)(F)F

DOS

IR

Vibrations