Geometry & MOs

Info

ID:	341650
PubChem CID:	127264343
Reduced:	NiP3C36H84 (1)
Stoich.:	AB3C36D84 (1)
Weight, g/mol:	886.268592
ΔH_f, kcal/mol:	-122.35
Dipole, Da:	5.87
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.770962
Charge, e:	4

Chem-info

IUPAC name:

3-diphenylphosphaniumylpropyl(diphenyl)phosphanium;nickel

Drug info:

PubChemData

Smile

CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.[Ni]

DOS

IR

Vibrations