Geometry & MOs

Info

ID:

411751

PubChem CID:

135084585

Reduced:

ClNiP2N3C38H39 (1)

Stoich.:

ABC2D3E38F39 (1)

Weight, g/mol:

601.277572

ΔHf, kcal/mol:

107.28

Dipole, Da:

7.23

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.986823

Charge, e:

 0

Chem-info

IUPAC name:

2-[diphenyl(phenylimino)-lambda5-phosphanyl]-N-[(Z)-2-di(propan-2-yl)phosphinimyl-1-phenylethenyl]aniline

Drug info:

PubChemData

Smile

CC(C)P(=[N-])(/C=C(/C1=CC=CC=C1)\[N-]C2=CC=CC=C2P(=NC3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(C)C.Cl[Ni]

DOS

IR

Vibrations