iron(2+); 1,10-phenanthroline; ditetrafluoroborate

Systemtic Name: iron(2+); 1,10-phenanthroline; ditetrafluoroborate Openeye Name: ferrous 1,10-phenanthroline ditetrafluoroborate CAS Name: iron(2+); 1,10-phenanthroline; ditetrafluoroborate IUPAC Name: iron(2+); 1,10-phenanthroline; ditetrafluoroborate Traditional Name: ferrous 1,10-phenanthroline ditetrafluoroborate Formula: C36H24B2F8FeN6 MolecularWeight: 770.070186

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Fe+2]

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Fe+2]

InChI

InChI=1S/3C12H8N2.2BF4.Fe/c3*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*2-1(3,4)5;/h3*1-8H;;;/q;;;2*-1;+2