Geometry & MOs

Info

ID:

388867

PubChem CID:

134990479

Reduced:

SN2O4C20H24 (1)

Stoich.:

AB2C4D20E24 (1)

Weight, g/mol:

473.19035

ΔHf, kcal/mol:

-138.28

Dipole, Da:

7.67

IP(EA), eV:

 -8.57(-0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

prop-2-enyl 2-[(3S,4R)-3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-2-oxo-4-[(2R)-oxolane-2-carbonyl]sulfanylazetidin-1-yl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)N[C@@H]2CCC3=C(C2)C4=CC=CC=C4N3.OS(=O)(=O)O

DOS

IR

Vibrations