Geometry & MOs

Info

ID:

180555

PubChem CID:

76653244

Reduced:

FNSiO9C36H40 (1)

Stoich.:

ABCD9E36F40 (1)

Weight, g/mol:

673.15206

ΔHf, kcal/mol:

-351.34

Dipole, Da:

3.76

IP(EA), eV:

 -8.5(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-1-(4-iodophenyl)-4-oxoazetidin-3-yl]-1-(4-fluorophenyl)propyl] acetate

Drug info:

PubChemData

Smile

COC(=O)C1C(C(C(C(O1)OC2=CC=C(C=C2)C3C(C(=O)N3C4=CC=C(C=C4)C#C[Si](C)(C)C)CCC(C5=CC=C(C=C5)F)O)O)O)O

DOS

IR

Vibrations