cyclopentane; iron(2+); tris(2-methylcyclopentyl)phosphane

Systemtic Name: cyclopentane; iron(2+); tris(2-methylcyclopentyl)phosphane Openeye Name: triferrous; cyclopentane; tris(2-methylcyclopentyl)phosphane CAS Name: cyclopentane; iron(2+); tris(2-methylcyclopentyl)phosphine IUPAC Name: cyclopentane; iron(2+); tris(2-methylcyclopentyl)phosphane Traditional Name: triferrous; cyclopentane; tris(2-methylcyclopentyl)phosphine Formula: C33H33Fe3P+6 MolecularWeight: 628.123881

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Descriptors Computed from Structure

Canonical SMILES:

C[C]1[CH][CH][CH][C]1P([C]2[CH][CH][CH][C]2C)[C]3[CH][CH][CH][C]3C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2].[Fe+2]

Isomeric SMILES

C[C]1[CH][CH][CH][C]1P([C]2[CH][CH][CH][C]2C)[C]3[CH][CH][CH][C]3C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2].[Fe+2]

InChI

InChI=1S/C18H18P.3C5H5.3Fe/c1-13-7-4-10-16(13)19(17-11-5-8-14(17)2)18-12-6-9-15(18)3;3*1-2-4-5-3-1;;;/h4-12H,1-3H3;3*1-5H;;;/q;;;;3*+2