Geometry & MOs

Info

ID:	86710
PubChem CID:	49888592
Reduced:	ClFNSO2H11C17 (1)
Stoich.:	ABCDE2F11G17 (1)
Weight, g/mol:	516.112185
ΔH_f, kcal/mol:	-73.13
Dipole, Da:	3.62
IP(EA), eV:	-9.58(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(4-chlorophenyl)methyl]-5-[[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)Cl

DOS

IR

Vibrations