Geometry & MOs

Info

ID:	87014
PubChem CID:	49890567
Reduced:	SCl2N2O2H12C16 (1)
Stoich.:	AB2C2D2E12F16 (1)
Weight, g/mol:	472.085971
ΔH_f, kcal/mol:	-44.39
Dipole, Da:	8.85
IP(EA), eV:	-8.66(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-[(2-chlorophenyl)methoxy]phenyl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)Cl)C)/C=C\3/C(=O)NC(=O)S3

DOS

IR

Vibrations