cobalt(2+); cyclopenta-1,3-diene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene

Systemtic Name: cobalt(2+); cyclopenta-1,3-diene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene Openeye Name: cobaltous; cyclopenta-1,3-diene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene CAS Name: cobalt(2+); cyclopenta-1,3-diene; (2,3,4-triphenyl-1-cyclobuta-1,3-dienyl)benzene IUPAC Name: cobalt(2+); cyclopenta-1,3-diene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene Traditional Name: cobaltous; cyclopenta-1,3-diene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene Formula: C33H25Co+ MolecularWeight: 480.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1=CC=C(C=C1)C2=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Co+2]

Isomeric SMILES

C1C=CC=[C-]1.C1=CC=C(C=C1)C2=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Co+2]

InChI

InChI=1S/C28H20.C5H5.Co/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)28(24-19-11-4-12-20-24)27(25)23-17-9-3-10-18-23;1-2-4-5-3-1;/h1-20H;1-3H,4H2;/q;-1;+2