Geometry & MOs

Info

ID:

173005

PubChem CID:

75582698

Reduced:

FO3N4H25C27 (1)

Stoich.:

AB3C4D25E27 (1)

Weight, g/mol:

455.197774

ΔHf, kcal/mol:

-40.71

Dipole, Da:

7.22

IP(EA), eV:

 -9.28(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methylpropyl 2-[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-6-oxocyclohexa-2,4-dien-1-ylidene]-4-methyl-1,3-thiazolidine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=NOC(=C2NC(=O)OC(C)C3=CC=CC=C3F)C)C4=CC=C(C=C4)C(=N)N

DOS

IR

Vibrations