Geometry & MOs

Info

ID:	120666
PubChem CID:	50739786
Reduced:	SN3O5C19H23 (1)
Stoich.:	AB3C5D19E23 (1)
Weight, g/mol:	382.995382
ΔH_f, kcal/mol:	-152.43
Dipole, Da:	5.73
IP(EA), eV:	-8.74(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-(4-chlorophenyl)-5-(quinoxalin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CN2C(=O)/C(=C/C3=C(C(=CC=C3)OC)OC)/SC2=O

DOS

IR

Vibrations