Geometry & MOs

Info

ID:

302675

PubChem CID:

124391964

Reduced:

SF2N2O6H16C24 (1)

Stoich.:

AB2C2D6E16F24 (1)

Weight, g/mol:

444.135508

ΔHf, kcal/mol:

-235.51

Dipole, Da:

4.2

IP(EA), eV:

 -9.14(-1.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 5-[[(5E)-5-[[4-(diethylamino)-2-methoxyphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C/3\C(=O)N(C(=O)S3)CC(=O)NC4=C(C=C(C=C4)F)F

DOS

IR

Vibrations