benzo[a]anthracen-1-ylphosphanium tetraborate

Systemtic Name: benzo[a]anthracen-1-ylphosphanium tetraborate Openeye Name: benzo[a]anthracen-1-ylphosphonium tetraborate CAS Name: 1-benzo[a]anthracenylphosphonium tetraborate IUPAC Name: benzo[a]anthracen-1-ylphosphanium tetraborate Traditional Name: benz[a]anthracen-1-ylphosphonium tetraborate Formula: C216H168B4O12P12 MolecularWeight: 3370.567052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+]

Isomeric SMILES

B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+].C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C(=CC=C4)[PH3+]

InChI

InChI=1S/12C18H13P.4BO3/c12*19-17-7-3-6-12-8-9-15-10-13-4-1-2-5-14(13)11-16(15)18(12)17;4*2-1(3)4/h12*1-11H,19H2;;;;/q;;;;;;;;;;;;4*-3/p+12