6331 1 2 3 4 5 1 1 1 1 1 1 2 3 4 1 1 1 1 5 255 1 2 3 4 2.5369 3.0739 2 2.5369 0.155 0.465 0.465 -0.465 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371020000000000000000000000000000000000000000000000000000000000000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 borane InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/BH3/h1H3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 UORVGPXVDQYIDP-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 14.0327803 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 BH3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 13.84 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 B SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 B Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 14.0327803 1 0 0 0 0 0 0 0 1 -1