Geometry & MOs

Info

ID:	87510
PubChem CID:	49895124
Reduced:	FNSO4H22C26 (1)
Stoich.:	ABCD4E22F26 (1)
Weight, g/mol:	511.02531
ΔH_f, kcal/mol:	-116.75
Dipole, Da:	5.65
IP(EA), eV:	-8.7(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)/C(=C/C3=CC(=C(C=C3)OC)OCC4=CC=CC=C4F)/SC2=O

DOS

IR

Vibrations