Geometry & MOs

Info

ID:	124111
PubChem CID:	50872806
Reduced:	ON2S2C22H24 (1)
Stoich.:	AB2C2D22E24 (1)
Weight, g/mol:	501.002691
ΔH_f, kcal/mol:	21.38
Dipole, Da:	7.73
IP(EA), eV:	-8.24(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)C3=C(C=C(C=C3)C)C

DOS

IR

Vibrations