Geometry & MOs

Info

ID:	9711
PubChem CID:	92533
Reduced:	MnNaN2O7C10H15 (1)
Stoich.:	ABC2D7E10F15 (1)
Weight, g/mol:	353.015738
ΔH_f, kcal/mol:	-144.38
Dipole, Da:	14.36
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 3.197002
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(2-hydroxyethyl)amino]acetate;manganese(2+)

Drug info:

PubChemData

Smile

C(CN(CC(=O)[O-])CC(=O)[O-])N(CCO)CC(=O)[O-].[Na+].[Mn+2]

DOS

IR

Vibrations