Geometry & MOs

Info

ID:	171226
PubChem CID:	75346223
Reduced:	N2S2O6H22C23 (1)
Stoich.:	A2B2C6D22E23 (1)
Weight, g/mol:	599.07773
ΔH_f, kcal/mol:	-185.9
Dipole, Da:	6.28
IP(EA), eV:	-9.07(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-bromo-5-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-[2-(2,5-dimethylphenoxy)ethyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCC4

DOS

IR

Vibrations