Geometry & MOs

Info

ID:	88064
PubChem CID:	49900376
Reduced:	NSCl2O4H13C18 (1)
Stoich.:	ABC2D4E13F18 (1)
Weight, g/mol:	500.036434
ΔH_f, kcal/mol:	-114.64
Dipole, Da:	3.82
IP(EA), eV:	-8.76(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,6-dichlorophenyl)methyl]-5-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)O)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations