Geometry & MOs

Info

ID:	87927
PubChem CID:	49898674
Reduced:	ClFSN2O2H20C30 (1)
Stoich.:	ABCD2E2F20G30 (1)
Weight, g/mol:	488.155849
ΔH_f, kcal/mol:	-16.32
Dipole, Da:	6.24
IP(EA), eV:	-8.56(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(1-benzyl-2-methylindol-3-yl)methylidene]-3-(naphthalen-2-ylmethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)CN3C(=O)/C(=C/C4=CN(C5=CC=CC=C54)CC6=C(C=CC=C6Cl)F)/SC3=O

DOS

IR

Vibrations