Geometry & MOs

Info

ID:

381133

PubChem CID:

134971782

Reduced:

PO2H14C18 (1)

Stoich.:

AB2C14D18 (1)

Weight, g/mol:

432.256549

ΔHf, kcal/mol:

15.29

Dipole, Da:

4.52

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.860934

Charge, e:

0

Chem-info

IUPAC name:

(4S,5S)-4,5-diphenyl-1,3-bis[(1R)-1-phenylethyl]imidazolidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P(C2=CC=CC=C2)C\3=CC=C/C3=C(/O)\[O-]

DOS

IR

Vibrations