Geometry & MOs

Info

ID:

87126

PubChem CID:

49892558

Reduced:

ClFSN2O4H18C25 (1)

Stoich.:

ABCD2E4F18G25 (1)

Weight, g/mol:

597.997997

ΔHf, kcal/mol:

-124.99

Dipole, Da:

4.08

IP(EA), eV:

 -9.07(-1.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-3-[(2,4-dichlorophenyl)methyl]-5-[[3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN2C(=O)/C(=C/C3=CC(=CC=C3)OCC(=O)NC4=CC=C(C=C4)Cl)/SC2=O)F

DOS

IR

Vibrations