gadolinium; [1,1,1,2,2,3,3-heptakis(fluoranyl)-7,7-dimethyl-6-oxidaniumylidene-octan-4-ylidene]oxidanium

Systemtic Name: gadolinium; [1,1,1,2,2,3,3-heptakis(fluoranyl)-7,7-dimethyl-6-oxidaniumylidene-octan-4-ylidene]oxidanium Openeye Name: (1-tert-butyl-4,4,5,5,6,6,6-heptafluoro-3-oxoniumylidene-hexylidene)oxonium; gadolinium CAS Name: gadolinium; (1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-6-oxoniumylideneoctan-4-ylidene)oxonium IUPAC Name: gadolinium; (1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-6-oxoniumylideneoctan-4-ylidene)oxidanium Traditional Name: (1-tert-butyl-4,4,5,5,6,6,6-heptafluoro-3-oxoniumylidene-hexylidene)oxonium; gadolinium Formula: C30H39F21GdO6+6 MolecularWeight: 1051.843527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.[Gd]

Isomeric SMILES

CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.CC(C)(C)C(=[OH+])CC(=[OH+])C(C(C(F)(F)F)(F)F)(F)F.[Gd]

InChI

InChI=1S/3C10H11F7O2.Gd/c3*1-7(2,3)5(18)4-6(19)8(11,12)9(13,14)10(15,16)17;/h3*4H2,1-3H3;/p+6