copper(1+); tris[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]boron(1-)

Systemtic Name: copper(1+); tris[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]boron(1-) Openeye Name: dicuprous tris[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]boron(1-) CAS Name: copper(1+); tris[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]boron(1-) IUPAC Name: copper(1+); tris[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]boron(1-) Traditional Name: dicuprous tris[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]boron(1-) Formula: C30H24B2Cu2F18N12 MolecularWeight: 1043.277218

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Descriptors Computed from Structure

Canonical SMILES:

[B-](N1C(=CC(=N1)C(F)(F)F)C)(N2C(=CC(=N2)C(F)(F)F)C)N3C(=CC(=N3)C(F)(F)F)C.[B-](N1C(=CC(=N1)C(F)(F)F)C)(N2C(=CC(=N2)C(F)(F)F)C)N3C(=CC(=N3)C(F)(F)F)C.[Cu+].[Cu+]

Isomeric SMILES

[B-](N1C(=CC(=N1)C(F)(F)F)C)(N2C(=CC(=N2)C(F)(F)F)C)N3C(=CC(=N3)C(F)(F)F)C.[B-](N1C(=CC(=N1)C(F)(F)F)C)(N2C(=CC(=N2)C(F)(F)F)C)N3C(=CC(=N3)C(F)(F)F)C.[Cu+].[Cu+]

InChI

InChI=1S/2C15H12BF9N6.2Cu/c2*1-7-4-10(13(17,18)19)26-29(7)16(30-8(2)5-11(27-30)14(20,21)22)31-9(3)6-12(28-31)15(23,24)25;;/h2*4-6H,1-3H3;;/q2*-1;2*+1