titanium(2+); tris(3,5-diethylpyrazol-1-yl)boron(1-); triiodide

Systemtic Name: titanium(2+); tris(3,5-diethylpyrazol-1-yl)boron(1-); triiodide Openeye Name: titanium(2+); tris(3,5-diethylpyrazol-1-yl)boron(1-); triiodide CAS Name: titanium(2+); tris(3,5-diethyl-1-pyrazolyl)boron(1-); triiodide IUPAC Name: titanium(2+); tris(3,5-diethylpyrazol-1-yl)boron(1-); triiodide Traditional Name: titanium(2+); tris(3,5-diethylpyrazol-1-yl)boron(1-); triiodide Formula: C21H33BI3N6Ti-2 MolecularWeight: 808.91833

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Descriptors Computed from Structure

Canonical SMILES:

[B-](N1C(=CC(=N1)CC)CC)(N2C(=CC(=N2)CC)CC)N3C(=CC(=N3)CC)CC.[Ti+2].[I-].[I-].[I-]

Isomeric SMILES

[B-](N1C(=CC(=N1)CC)CC)(N2C(=CC(=N2)CC)CC)N3C(=CC(=N3)CC)CC.[Ti+2].[I-].[I-].[I-]

InChI

InChI=1S/C21H33BN6.3HI.Ti/c1-7-16-13-19(10-4)26(23-16)22(27-20(11-5)14-17(8-2)24-27)28-21(12-6)15-18(9-3)25-28;;;;/h13-15H,7-12H2,1-6H3;3*1H;/q-1;;;;+2/p-3