Geometry & MOs

Info

ID:	189839
PubChem CID:	77912762
Reduced:	N2O2S2C31H32 (1)
Stoich.:	A2B2C2D31E32 (1)
Weight, g/mol:	469.149384
ΔH_f, kcal/mol:	32.46
Dipole, Da:	2.72
IP(EA), eV:	-8.68(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-[4-[3-(diethylamino)propoxy]phenyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC)CCCOC1=CC=C(C=C1)N2C(=O)C(=CC=C(C3=CC=CC=C3)C4=CC=CC=C4)SC2=S

DOS

IR

Vibrations