tris[2-(3-tert-butyl-2H-1,2,3,4-tetrazol-4-yl)phenyl]borane

Systemtic Name: tris[2-(3-tert-butyl-2H-1,2,3,4-tetrazol-4-yl)phenyl]borane Openeye Name: tris[2-(3-tert-butyl-2H-tetrazol-4-yl)phenyl]borane CAS Name: tris[2-(3-tert-butyl-2H-tetrazol-4-yl)phenyl]borane IUPAC Name: tris[2-(3-tert-butyl-2H-tetrazol-4-yl)phenyl]borane Traditional Name: tris[2-(3-tert-butyl-2H-tetrazol-4-yl)phenyl]borane Formula: C33H45BN12 MolecularWeight: 620.6018

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1N2C=NNN2C(C)(C)C)(C3=CC=CC=C3N4C=NNN4C(C)(C)C)C5=CC=CC=C5N6C=NNN6C(C)(C)C

Isomeric SMILES

B(C1=CC=CC=C1N2C=NNN2C(C)(C)C)(C3=CC=CC=C3N4C=NNN4C(C)(C)C)C5=CC=CC=C5N6C=NNN6C(C)(C)C

InChI

InChI=1S/C33H45BN12/c1-31(2,3)44-38-35-22-41(44)28-19-13-10-16-25(28)34(26-17-11-14-20-29(26)42-23-36-39-45(42)32(4,5)6)27-18-12-15-21-30(27)43-24-37-40-46(43)33(7,8)9/h10-24,38-40H,1-9H3