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

Systemtic Name: carbanide; titanium(3+); tris(3,5-diethylpyrazol-1-yl)boron(1-) Openeye Name: carbanide; titanium(3+); tris(3,5-diethylpyrazol-1-yl)boron(1-) CAS Name: carbanide; titanium(3+); tris(3,5-diethyl-1-pyrazolyl)boron(1-) IUPAC Name: carbanide; titanium(3+); tris(3,5-diethylpyrazol-1-yl)boron(1-) Traditional Name: carbanide; titanium(3+); tris(3,5-diethylpyrazol-1-yl)boron(1-) Formula: C24H42BN6Ti- MolecularWeight: 473.30848

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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.[CH3-].[CH3-].[CH3-].[Ti+3]

Isomeric SMILES

[B-](N1C(=CC(=N1)CC)CC)(N2C(=CC(=N2)CC)CC)N3C(=CC(=N3)CC)CC.[CH3-].[CH3-].[CH3-].[Ti+3]

InChI

InChI=1S/C21H33BN6.3CH3.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*1H3;/q4*-1;+3