Geometry & MOs

Info

ID:	195186
PubChem CID:	78652394
Reduced:	OSCl2N4H14C16 (1)
Stoich.:	ABC2D4E14F16 (1)
Weight, g/mol:	385.055484
ΔH_f, kcal/mol:	37.35
Dipole, Da:	4.2
IP(EA), eV:	-8.9(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CC(C)NC(=O)C(=CC1=C(N=C(S1)NC2=CC=CC=C2Cl)Cl)C#N

DOS

IR

Vibrations