cyclopenta-1,3-diene; ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane CAS Name: cyclopenta-1,3-diene; ditert-butyl(1-cyclopenta-1,3-dienyl)phosphine; iron(2+) IUPAC Name: cyclopenta-1,3-diene; ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphine Formula: C18H27FeP MolecularWeight: 330.225741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.[CH-]1C=CC=C1.[Fe+2]

Isomeric SMILES

CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.[CH-]1C=CC=C1.[Fe+2]

InChI

InChI=1S/C13H22P.C5H5.Fe/c1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;1-2-4-5-3-1;/h7-10H,1-6H3;1-5H;/q2*-1;+2