trilithium trimagnesium tripotassium bis(oxidanidyl)-oxidanylidene-titanium tetratetrafluoroborate

Systemtic Name: trilithium trimagnesium tripotassium bis(oxidanidyl)-oxidanylidene-titanium tetratetrafluoroborate Openeye Name: trilithium trimagnesium tripotassium dioxido(oxo)titanium tetratetrafluoroborate CAS Name: trilithium trimagnesium tripotassium dioxido(oxo)titanium tetratetrafluoroborate IUPAC Name: trilithium trimagnesium tripotassium dioxido(oxo)titanium tetratetrafluoroborate Traditional Name: trilithium trimagnesium tripotassium keto(dioxido)titanium tetratetrafluoroborate Formula: B4F16K3Li3Mg3O12Ti4 MolecularWeight: 941.712151

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].[Li+].[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[Mg+2].[Mg+2].[Mg+2].[K+].[K+].[K+]

Isomeric SMILES

[Li+].[Li+].[Li+].[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[O-][Ti](=O)[O-].[Mg+2].[Mg+2].[Mg+2].[K+].[K+].[K+]

InChI

InChI=1S/4BF4.3K.3Li.3Mg.12O.4Ti/c4*2-1(3,4)5;;;;;;;;;;;;;;;;;;;;;;;;;/q4*-1;6*+1;3*+2;;;;;8*-1;;;;