Geometry & MOs

Info

ID:	163142
PubChem CID:	57646561
Reduced:	NO4H13C15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	480.997606
ΔH_f, kcal/mol:	-129.33
Dipole, Da:	9.74
IP(EA), eV:	-9.93(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5E)-5-[[3-[2-(2,4-dichlorophenyl)ethyl]-4-methoxyphenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)C2=C(C(=CC=C2)C(=O)O)O

DOS

IR

Vibrations