2,1-benzothiazol-1-ium; fluoranyl-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane

Systemtic Name: 2,1-benzothiazol-1-ium; fluoranyl-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane Openeye Name: 2,1-benzothiazol-1-ium; fluoro-dioxido-oxo-$l^{5}-phosphane CAS Name: 2,1-benzothiazol-1-ium; fluoro-dioxido-oxophosphorane IUPAC Name: 2,1-benzothiazol-1-ium; fluoro-dioxido-oxo-$l^{5}-phosphane Traditional Name: 2,1-benzothiazol-1-ium; fluoro-keto-dioxido-phosphorane Formula: C84H72F6N12O18P6S12 MolecularWeight: 2222.153065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F

Isomeric SMILES

C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.C1=CC2=CS[NH+]=C2C=C1.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F.[O-]P(=O)([O-])F

InChI

InChI=1S/12C7H5NS.6FH2O3P/c12*1-2-4-7-6(3-1)5-9-8-7;6*1-5(2,3)4/h12*1-5H;6*(H2,2,3,4)