Geometry & MOs

Info

ID:	124026
PubChem CID:	50869985
Reduced:	SN2O3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	388.12792
ΔH_f, kcal/mol:	-107.08
Dipole, Da:	8.89
IP(EA), eV:	-8.09(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(7-methoxy-2,2,4-trimethyl-1-propylquinolin-6-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)OC)/C=C\3/C(=O)N(C(=O)S3)C)C(=CC1(C)C)C

DOS

IR

Vibrations