6857630 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 27 8 8 8 8 8 8 8 8 8 7 7 7 1 1 1 5 -1 9 -1 10 -1 11 1 12 1 13 1 1 1 1 1 1 1 2 2 3 3 4 4 5 6 7 8 9 10 2 3 4 5 6 7 11 14 12 15 13 16 11 12 13 11 12 13 6 6 6 6 6 6 1 1 1 1 1 1 1 2 2 2 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 3.3271 4.0342 2.62 4.0342 2.62 4.0342 2.62 2.6844 3.3271 3.97 3.3271 3.3271 3.3271 4.5092 2 4.5092 -0.1169 -0.8241 0.5902 -0.8241 -0.8241 0.5902 -0.8241 -2.2973 2.2973 -2.2971 -1.5312 1.2973 -1.5312 -0.4255 0.5902 -1.2226 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 128 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 9 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 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 0000037100033C000000001000000000000000005880000000000000000000000000000000000000000408000000000000000000000040000100000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cobalt;nitric acid InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/Co.3HNO3/c;3*2-1(3)4/h;3*(H,2,3,4) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 QSQUFRGBXGXOHF-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 247.920122 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 CoH3N3O9 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 247.97 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [N+](=O)(O)[O-].[N+](=O)(O)[O-].[N+](=O)(O)[O-].[Co] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [N+](=O)(O)[O-].[N+](=O)(O)[O-].[N+](=O)(O)[O-].[Co] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 198 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 247.920122 13 0 0 0 0 0 0 0 4 -1