Geometry & MOs

Info

ID:

88025

PubChem CID:

49900019

Reduced:

NSO3Cl4H11C21 (1)

Stoich.:

ABC3D4E11F21 (1)

Weight, g/mol:

626.96735

ΔHf, kcal/mol:

-58.98

Dipole, Da:

4.21

IP(EA), eV:

 -9.22(-1.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-3-[(3,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CN2C(=O)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)/SC2=O)Cl)Cl

DOS

IR

Vibrations