21123765 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 24 19 19 19 7 7 7 7 7 7 6 6 6 6 6 6 1 3 2 1 3 1 4 1 11 -1 12 -1 13 -1 14 -1 15 -1 16 -1 1 1 1 1 1 1 5 6 7 8 9 10 11 12 13 14 15 16 11 12 13 14 15 16 6 6 6 6 6 6 3 3 3 3 3 3 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 3.8508 5.5829 2 2.9848 4.7169 3.8508 3.8508 5.5829 2.9848 2 4.7169 3.8508 3.8508 4.7169 2.9848 2.9848 0 0 -0.6736 1.5 1.5 -2 2 -1 -1.5 0.6737 0.5 -1 1 -0.5 -0.5 0.5 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 127 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 12 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 00000371006380000060008000000000000000000000000000000000000000000000000000000004000000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 chromic;tripotassium;hexacyanide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 tripotassium;chromium(3+);hexacyanide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 tripotassium;chromium(3+);hexacyanide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 tripotassium;chromium(3+);hexacyanide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 tripotassium;chromium(3+);hexacyanide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 chromic;tripotassium;hexacyanide InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/6CN.Cr.3K/c6*1-2;;;;/q6*-1;+3;3*+1 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 XYBUIQUQPGBKAR-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 324.850068 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C6CrK3N6 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 325.40 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[Cr+3] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[Cr+3] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 143 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 324.850068 16 0 0 0 0 0 0 0 10 -1