Geometry & MOs

Info

ID:

87727

PubChem CID:

49896837

Reduced:

FISN2O6H22C24 (1)

Stoich.:

ABCD2E6F22G24 (1)

Weight, g/mol:

613.96808

ΔHf, kcal/mol:

-199.11

Dipole, Da:

3.04

IP(EA), eV:

 -9.06(-1.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-4-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)N3CCOCC3)I)OCC4=CC=CC=C4F

DOS

IR

Vibrations