Geometry & MOs

Info

ID:	171164
PubChem CID:	75337029
Reduced:	SN2O7C25H26 (1)
Stoich.:	AB2C7D25E26 (1)
Weight, g/mol:	461.069986
ΔH_f, kcal/mol:	-234.39
Dipole, Da:	3.07
IP(EA), eV:	-8.82(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[5-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)OC)OCC(=O)NC3=C(C=C(C=C3)C)C

DOS

IR

Vibrations