iron(6+); isocyanomethylbenzene; dicyanide

Systemtic Name: iron(6+); isocyanomethylbenzene; dicyanide Openeye Name: iron(6+); isocyanomethylbenzene; dicyanide CAS Name: iron(6+); isocyanomethylbenzene; dicyanide IUPAC Name: iron(6+); isocyanomethylbenzene; dicyanide Traditional Name: iron(6+); isocyanomethylbenzene; dicyanide Formula: C34H28FeN6+4 MolecularWeight: 576.47132

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#N.[C-]#N.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[Fe+6]

Isomeric SMILES

[C-]#N.[C-]#N.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[C-]#[N+]CC1=CC=CC=C1.[Fe+6]

InChI

InChI=1S/4C8H7N.2CN.Fe/c4*1-9-7-8-5-3-2-4-6-8;2*1-2;/h4*2-6H,7H2;;;/q;;;;2*-1;+6