66227 1 2 7 5 1 2 3 1 5 255 1 2 2 3 0 0 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.396 Cactvs xemistry.com 2012.02.08 10 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.396 Cactvs xemistry.com 2012.02.08 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.396 Cactvs xemistry.com 2012.02.08 0 Count Rotatable Bond 5 E_NROTBONDS 3.396 Cactvs xemistry.com 2012.02.08 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.396 Cactvs xemistry.com 2012.02.08 00000371020200000000000000000000000000000000000000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.1.0 LexiChem openeye.com 2012.02.08 nitridoborane IUPAC Name CAS-like Style 1 2.1.0 LexiChem openeye.com 2012.02.08 nitriloborane IUPAC Name Preferred 1 2.1.0 LexiChem openeye.com 2012.02.08 azanylidyneborane IUPAC Name Systematic 1 2.1.0 LexiChem openeye.com 2012.02.08 azanylidyneborane IUPAC Name Traditional 1 2.1.0 LexiChem openeye.com 2012.02.08 nitriloborane InChI Standard 1 1.0.4 InChI iupac.org 2012.02.08 InChI=1S/BN/c1-2 InChIKey Standard 1 1.0.4 InChI iupac.org 2012.02.08 PZNSFCLAULLKQX-UHFFFAOYSA-N Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2012.02.08 25.012379 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2012.02.08 BN Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2012.02.08 24.8177 SMILES Canonical 1 1.7.6 OEChem openeye.com 2012.02.08 B#N SMILES Isomeric 1 1.7.6 OEChem openeye.com 2012.02.08 B#N Topological Polar Surface Area 7 E_TPSA 3.396 Cactvs xemistry.com 2012.02.08 23.8 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2012.02.08 25.012379 2 0 0 0 0 0 0 0 1 1