518530 1 2 3 4 5 6 7 8 13 13 6 6 1 1 1 1 2 2 3 -1 4 -1 1 1 1 1 1 2 2 2 3 3 4 5 6 7 3 4 8 4 6 6 1 1 1 6 6 1 3 1 5 255 1 2 3 4 5 6 7 8 4.0374 2.5369 3.5374 3.0374 4.5743 3.9726 4.539 2 0.2798 -0.5864 -0.5862 0.2798 0.5898 0.8964 -0.0846 -0.8964 0 Compound Canonicalized 5 2007.06.29 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 12 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 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 00000371804000000000100000000000000010204800000000000000000000000000000000000008000000020000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 alumane;aluminum(2+) monohydride;acetylide InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C2.2Al.4H/c1-2;;;;;;/q-2;;+2;;;; InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 ZHBHAFIGXVMXQZ-UHFFFAOYSA-N Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 81.994377 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C2H4Al2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 82.02 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 [C-]#[C-].[AlH3].[AlH+2] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 [C-]#[C-].[AlH3].[AlH+2] 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 81.994377 4 0 0 0 0 0 0 0 3 -1