NFV

NI-FE OXIDIZED ACTIVE CENTER

Created:2010-07-14
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count9
Chiral Atom Count0
Bond Count8
Aromatic Bond Count0
2D diagram of NFV

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Chemical Component Summary

NameNI-FE OXIDIZED ACTIVE CENTER
FormulaC3 Fe N2 Ni O2
Molecular Weight210.583
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.370[Ni]O[Fe](|[C-]#[O+])(C#N)C#N
SMILESOpenEye OEToolkits1.7.0C(#N)[Fe](C#N)(C#O)O[Ni]
Canonical SMILESCACTVS3.370 [Ni]O[Fe](|[C-]#[O+])(C#N)C#N
Canonical SMILESOpenEye OEToolkits1.7.0 C(#N)[Fe](C#N)(C#O)O[Ni]
InChIInChI1.03 InChI=1S/2CN.CO.Fe.Ni.O/c3*1-2;;;
InChIKeyInChI1.03 MPQMGFDSXFFIQL-UHFFFAOYSA-N