161221 1 2 3 4 5 6 7 8 9 22 9 9 9 9 9 9 1 1 1 4 2 -1 3 -1 4 -1 5 -1 6 -1 7 -1 8 1 9 1 1 5 255 1 2 3 4 5 6 7 8 9 3.866 1 4.366 4.732 3 3.366 4.366 0 3.366 3.366 1.866 0 3.866 2.866 4.232 2.5 1.866 0 0 Compound Canonicalized 5 2019.01.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 6 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371000001C00000020000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 hydron;titanium(4+);hexafluoride InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/6FH.Ti/h6*1H;/q;;;;;;+4/p-4 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 PFSXARRIPPWGNC-UHFFFAOYSA-J Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 163.9540097 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 F6H2Ti Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.08.13 163.873 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 [H+].[H+].[F-].[F-].[F-].[F-].[F-].[F-].[Ti+4] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 [H+].[H+].[F-].[F-].[F-].[F-].[F-].[F-].[Ti+4] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 163.9540097 7 0 0 0 0 0 0 0 9 -1