123308 1 2 3 4 8 8 5 3 1 -1 4 1 1 1 2 3 4 3 1 7 2 1 5 255 1 2 3 4 2.866 4.5981 3.732 2 -0.25 -0.25 0.25 0.25 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.408 Cactvs xemistry.com 2012.11.26 13.5 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.408 Cactvs xemistry.com 2012.11.26 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.408 Cactvs xemistry.com 2012.11.26 0 Count Rotatable Bond 5 E_NROTBONDS 3.408 Cactvs xemistry.com 2012.11.26 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.408 Cactvs xemistry.com 2012.11.26 000003710A0030000000000000000000000000000000000000000000000000000000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.2.0 LexiChem openeye.com 2012.11.26 lithium;oxido(oxo)borane IUPAC Name CAS-like Style 1 2.2.0 LexiChem openeye.com 2012.11.26 lithium;oxido(oxo)borane IUPAC Name Preferred 1 2.2.0 LexiChem openeye.com 2012.11.26 lithium;oxido(oxo)borane IUPAC Name Systematic 1 2.2.0 LexiChem openeye.com 2012.11.26 lithium;oxidanidyl(oxidanylidene)borane IUPAC Name Traditional 1 2.2.0 LexiChem openeye.com 2012.11.26 lithium;keto(oxido)borane InChI Standard 1 1.0.4 InChI iupac.org 2012.11.26 InChI=1S/BO2.Li/c2-1-3;/q-1;+1 InChIKey Standard 1 1.0.4 InChI iupac.org 2012.11.26 HZRMTWQRDMYLNW-UHFFFAOYSA-N Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 50.015139 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 BLiO2 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 49.7508 SMILES Canonical 1 1.9.0 OEChem openeye.com 2012.11.26 [Li+].B(=O)[O-] SMILES Isomeric 1 1.9.0 OEChem openeye.com 2012.11.26 [Li+].B(=O)[O-] Topological Polar Surface Area 7 E_TPSA 3.408 Cactvs xemistry.com 2012.11.26 40.1 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 50.015139 4 0 0 0 0 0 0 0 2 1