Geometry & MOs

Info

ID:

409953

PubChem CID:

135082740

Reduced:

ZnN2S2F6O8C25H26 (1)

Stoich.:

AB2C2D6E8F25G26 (1)

Weight, g/mol:

766.00696

ΔHf, kcal/mol:

-602.0

Dipole, Da:

10.41

IP(EA), eV:

 -9.58(-1.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-4-benzyl-2-[2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dihydro-1,3-oxazole;palladium(2+);trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC(C)(C1=N[C@H](CO1)CC2=CC=CC=C2)C3=N[C@H](CO3)CC4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zn+2]

DOS

IR

Vibrations