Geometry & MOs

Info

ID:

219882

PubChem CID:

85165004

Reduced:

NO8C35H49 (1)

Stoich.:

AB8C35D49 (1)

Weight, g/mol:

611.273686

ΔHf, kcal/mol:

-392.66

Dipole, Da:

3.63

IP(EA), eV:

 -9.01(-0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3-[1-[tert-butyl(dimethyl)silyl]oxyethyl]-1-(2-ethoxy-2-oxo-1-phenylsulfanylethyl)-4-oxoazetidin-2-yl]pent-2-enyl benzoate

Drug info:

PubChemData

Smile

CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)OC=O)C)OC(=O)C)OC(=O)NC5=CC=CC=C5)C

DOS

IR

Vibrations