Geometry & MOs

Info

ID:	88369
PubChem CID:	49903071
Reduced:	NSCl2O5H17C25 (1)
Stoich.:	ABC2D5E17F25 (1)
Weight, g/mol:	497.00966
ΔH_f, kcal/mol:	-118.8
Dipole, Da:	4.11
IP(EA), eV:	-9.22(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC(=O)C2=CC=CC=C2Cl)/C=C\3/C(=O)N(C(=O)S3)CC4=CC(=CC=C4)Cl

DOS

IR

Vibrations