Geometry & MOs

Info

ID:

409967

PubChem CID:

135082754

Reduced:

ZnCl2N2O10C24H30 (1)

Stoich.:

AB2C2D10E24F30 (1)

Weight, g/mol:

286.168128

ΔHf, kcal/mol:

-101.55

Dipole, Da:

6.18

IP(EA), eV:

 -9.08(-4.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S)-2-[2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4-methyl-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@H]1COC(=N1)C(C)(C)C2=N[C@H](CO2)CC3=CC=CC=C3.CC1=CC=CC=C1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]

DOS

IR

Vibrations