bis(4-tert-butylphenyl)-phenyl-sulfanium; tetraphenylboranuide

Systemtic Name: bis(4-tert-butylphenyl)-phenyl-sulfanium; tetraphenylboranuide Openeye Name: bis(4-tert-butylphenyl)-phenyl-sulfonium; tetraphenylboranuide CAS Name: bis(4-tert-butylphenyl)-phenylsulfonium; tetraphenylboranuide IUPAC Name: bis(4-tert-butylphenyl)-phenylsulfanium; tetraphenylboranuide Traditional Name: bis(4-tert-butylphenyl)-phenyl-sulfonium; tetraphenylboranuide Formula: C50H51BS MolecularWeight: 694.81594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31S.C24H20B/c1-25(2,3)20-12-16-23(17-13-20)27(22-10-8-7-9-11-22)24-18-14-21(15-19-24)26(4,5)6;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h7-19H,1-6H3;1-20H/q+1;-1