Geometry & MOs

Info

ID:	124133
PubChem CID:	50873155
Reduced:	NS2O3C24H27 (1)
Stoich.:	AB2C3D24E27 (1)
Weight, g/mol:	485.169451
ΔH_f, kcal/mol:	-57.13
Dipole, Da:	3.16
IP(EA), eV:	-8.78(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxyphenyl]methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCN1C(=O)/C(=C\C2=CC(=CC=C2)OCCOC3=CC=C(C=C3)C(C)(C)C)/SC1=S

DOS

IR

Vibrations