Geometry & MOs

Info

ID:	87054
PubChem CID:	49891318
Reduced:	INSO5H12C18 (1)
Stoich.:	ABCD5E12F18 (1)
Weight, g/mol:	466.015698
ΔH_f, kcal/mol:	-107.26
Dipole, Da:	3.38
IP(EA), eV:	-9.35(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)/C=C\2/C(=O)NC(=O)S2)I)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations