cyclopentane; 2-diphenylphosphanylethyl(diphenyl)phosphane; pent-1-enylideneiron(1+); tetrafluoroborate

Systemtic Name: cyclopentane; 2-diphenylphosphanylethyl(diphenyl)phosphane; pent-1-enylideneiron(1+); tetrafluoroborate Openeye Name: cyclopentane; 2-diphenylphosphanylethyl(diphenyl)phosphane; pent-1-enylideneiron(1+); tetrafluoroborate CAS Name: cyclopentane; 2-diphenylphosphinoethyl(diphenyl)phosphine; pent-1-enylideneiron(1+); tetrafluoroborate IUPAC Name: cyclopentane; 2-diphenylphosphanylethyl(diphenyl)phosphane; pent-1-enylideneiron(1+); tetrafluoroborate Traditional Name: cyclopentane; 2-diphenylphosphinoethyl(diphenyl)phosphine; pent-1-enylideneiron(1+); tetrafluoroborate Formula: C36H37BF4FeP2 MolecularWeight: 674.276115

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCC=C=[Fe+].C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1

Isomeric SMILES

[B-](F)(F)(F)F.CCCC=C=[Fe+].C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1

InChI

InChI=1S/C26H24P2.C5H5.C5H8.BF4.Fe/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-2-4-5-3-1;1-3-5-4-2;2-1(3,4)5;/h1-20H,21-22H2;1-5H;4H,3,5H2,1H3;;/q;;;-1;+1