1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide

Systemtic Name: 1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide Openeye Name: 1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide CAS Name: 1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide IUPAC Name: 1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide Traditional Name: 1,1-diphenylethylbenzene; tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide Formula: C52H29BF24 MolecularWeight: 1120.559337

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.[CH2+]C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.[CH2+]C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C32H12BF24.C20H17/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h1-12H;2-16H,1H2/q-1;+1