Geometry & MOs

Info

ID:

88062

PubChem CID:

49900371

Reduced:

BrNSCl2O4H22C27 (1)

Stoich.:

ABCD2E4F22G27 (1)

Weight, g/mol:

642.92841

ΔHf, kcal/mol:

-93.16

Dipole, Da:

7.14

IP(EA), eV:

 -8.87(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-3-[(3,4-dichlorophenyl)methyl]-5-[[4-[(4-fluorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC(=C(C=C3)Cl)Cl)Br)OCC4=CC=CC(=C4)C

DOS

IR

Vibrations