1,3-benzodithiol-3-ium; fluoranyl-bis(oxidanidyl)borane

Systemtic Name: 1,3-benzodithiol-3-ium; fluoranyl-bis(oxidanidyl)borane Openeye Name: 1,3-benzodithiol-3-ium; fluoro(dioxido)borane CAS Name: 1,3-benzodithiol-3-ium; fluoro(dioxido)borane IUPAC Name: 1,3-benzodithiol-3-ium; fluoro(dioxido)borane Traditional Name: 1,3-benzodithiol-3-ium; fluoro(dioxido)borane Formula: C56H40B4F4O8S16 MolecularWeight: 1473.189613

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Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2

Isomeric SMILES

B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2.C1=CC=C2C(=C1)SC=[S+]2

InChI

InChI=1S/8C7H5S2.4BFO2/c8*1-2-4-7-6(3-1)8-5-9-7;4*2-1(3)4/h8*1-5H;;;;/q8*+1;4*-2