cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4,4,6-trimethyl-1,3,2-dioxaborinane; iron

Systemtic Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4,4,6-trimethyl-1,3,2-dioxaborinane; iron Openeye Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4,4,6-trimethyl-1,3,2-dioxaborinane; iron CAS Name: cyclopenta-1,3-diene; 2-(1-cyclopenta-2,4-dienyl)-4,4,6-trimethyl-1,3,2-dioxaborinane; iron IUPAC Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4,4,6-trimethyl-1,3,2-dioxaborinane; iron Traditional Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4,4,6-trimethyl-1,3,2-dioxaborinane; iron Formula: C16H21BFeO2-2 MolecularWeight: 311.99274

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(CC(O1)(C)C)C)[C-]2C=CC=C2.[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

B1(OC(CC(O1)(C)C)C)[C-]2C=CC=C2.[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C11H16BO2.C5H5.Fe/c1-9-8-11(2,3)14-12(13-9)10-6-4-5-7-10;1-2-4-5-3-1;/h4-7,9H,8H2,1-3H3;1-5H;/q2*-1;