sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide

Systemtic Name: sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide Openeye Name: sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide CAS Name: sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide IUPAC Name: sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide Traditional Name: sodium tetrakis[2,5-bis(trifluoromethyl)phenyl]boranuide Formula: C32H12BF24Na MolecularWeight: 886.200127

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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