4-ethenyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonine; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; tetrafluoroborate

Systemtic Name: 4-ethenyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonine; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; tetrafluoroborate Openeye Name: ferrous; 1,2,3,4,5-pentamethylcyclopentane; 4-vinyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonine; tetrafluoroborate CAS Name: 4-ethenyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonin; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; tetrafluoroborate IUPAC Name: 4-ethenyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonine; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; tetrafluoroborate Traditional Name: ferrous; 1,2,3,4,5-pentamethylcyclopentane; 4-vinyl-1,2,3,5,6,7-hexahydro-1,4,7-benzotriphosphonin; tetrafluoroborate Formula: C22H32BF4FeP3+ MolecularWeight: 532.060376

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[C]1[C]([C]([C]([C]1C)C)C)C.C=CP1CCPC2=CC=CC=C2PCC1.[Fe+2]

Isomeric SMILES

[B-](F)(F)(F)F.C[C]1[C]([C]([C]([C]1C)C)C)C.C=CP1CCPC2=CC=CC=C2PCC1.[Fe+2]

InChI

InChI=1S/C12H17P3.C10H15.BF4.Fe/c1-2-15-9-7-13-11-5-3-4-6-12(11)14-8-10-15;1-6-7(2)9(4)10(5)8(6)3;2-1(3,4)5;/h2-6,13-14H,1,7-10H2;1-5H3;;/q;;-1;+2