Geometry & MOs

Info

ID:	87286
PubChem CID:	49893696
Reduced:	NSBr2O4H21C26 (1)
Stoich.:	ABC2D4E21F26 (1)
Weight, g/mol:	388.028456
ΔH_f, kcal/mol:	-66.49
Dipole, Da:	5.83
IP(EA), eV:	-9.03(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2-chloro-5-nitrophenyl)methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC(=C(C(=C3Br)Br)OCC4=CC=CC=C4)OC)/SC2=O

DOS

IR

Vibrations