Geometry & MOs

Info

ID:	125314
PubChem CID:	50919706
Reduced:	NiN2O8C10H16 (1)
Stoich.:	AB2C8D10E16 (1)
Weight, g/mol:	1352.694381
ΔH_f, kcal/mol:	-217.06
Dipole, Da:	7.87
IP(EA), eV:	-7.37(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	9

Chem-info

IUPAC name:

iron(3+);[tris(2-methylaziridin-1-yl)-lambda5-phosphanylidene]oxidanium

Drug info:

PubChemData

Smile

C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.[Ni+2]

DOS

IR

Vibrations