Geometry & MOs

Info

ID:	87492
PubChem CID:	49894963
Reduced:	NSCl2O5H19C26 (1)
Stoich.:	ABC2D5E19F26 (1)
Weight, g/mol:	483.130443
ΔH_f, kcal/mol:	-128.19
Dipole, Da:	4.11
IP(EA), eV:	-9.32(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylidene]-3-[(3-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl)OC)/SC2=O

DOS

IR

Vibrations