Geometry & MOs

Info

ID:	237580
PubChem CID:	92719818
Reduced:	ClSN2O3H15C22 (1)
Stoich.:	ABC2D3E15F22 (1)
Weight, g/mol:	458.130028
ΔH_f, kcal/mol:	-30.34
Dipole, Da:	9.41
IP(EA), eV:	-8.65(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-7-(4-methoxyphenyl)-3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1,6,7,8-tetrahydroquinoline-2,5-dione

Drug info:

PubChemData

Smile

C1[C@@H](CC(=O)C2=C1NC(=O)C(=C2)C3=NC(=CS3)C4=CC=C(C=C4)Cl)C5=CC=CO5

DOS

IR

Vibrations