Geometry & MOs

Info

ID:

394971

PubChem CID:

135024331

Reduced:

NPdC6H6 (1)

Stoich.:

ABC6D6 (1)

Weight, g/mol:

148.990428

ΔHf, kcal/mol:

106.31

Dipole, Da:

2.78

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.029467

Charge, e:

 0

Chem-info

IUPAC name:

carbanide;nickel(2+);2-phosphanylethylazanide

Drug info:

PubChemData

Smile

C1=CC=C([C-]=C1)N.[Pd]

DOS

IR

Vibrations