oxidanyl(oxidanylidene)alumane; 1,2,3,4,5-pentakis(fluoranyl)-6-[2,3,4,5,6-pentakis(fluoranyl)phenyl]benzene

Systemtic Name: oxidanyl(oxidanylidene)alumane; 1,2,3,4,5-pentakis(fluoranyl)-6-[2,3,4,5,6-pentakis(fluoranyl)phenyl]benzene Openeye Name: hydroxy(oxo)alumane; 1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)benzene CAS Name: hydroxy(oxo)alumane; 1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)benzene IUPAC Name: hydroxy(oxo)alumane; 1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)benzene Traditional Name: hydroxy(keto)alumane; 1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)benzene Formula: C48HAlF40O2 MolecularWeight: 1396.438006

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Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.O[Al]=O

Isomeric SMILES

C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F.O[Al]=O

InChI

InChI=1S/4C12F10.Al.H2O.O/c4*13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16;;;/h;;;;;1H2;/q;;;;+1;;/p-1