Geometry & MOs

Info

ID:

180553

PubChem CID:

76652789

Reduced:

F3N4O4C24H35 (1)

Stoich.:

A3B4C4D24E35 (1)

Weight, g/mol:

875.14502

ΔHf, kcal/mol:

-346.73

Dipole, Da:

3.25

IP(EA), eV:

 -8.88(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 3,4,5-triacetyloxy-6-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-iodophenyl)-4-oxoazetidin-2-yl]phenoxy]oxane-2-carboxylate

Drug info:

PubChemData

Smile

CCOCC1(CCC(C1)NC(=O)OC(C)(C)C)C(=O)N2CCN(CC2)C3=NC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations