Geometry & MOs

Info

ID:

409965

PubChem CID:

135082752

Reduced:

CuCl2N2O10C21H22 (1)

Stoich.:

AB2C2D10E21F22 (1)

Weight, g/mol:

637.96863

ΔHf, kcal/mol:

-8.13

Dipole, Da:

6.4

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.776312

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C1=N[C@H](CO1)C2=CC=CC=C2)C3=N[C@H](CO3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cu+2]

DOS

IR

Vibrations