516872 1 2 3 4 19 16 7 6 1 1 2 -1 1 2 3 2 4 4 7 1 3 1 5 255 1 2 3 4 2 2.866 4.5981 3.732 -0 -0.5 0.5 0 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 34.5 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 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 00000371000200004040000000000000000000000000000000000000000000000000000000000004040000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 potassium;thiocyanate InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/CHNS.K/c2-1-3;/h3H;/q;+1/p-1 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 ZNNZYHKDIALBAK-UHFFFAOYSA-M Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 96.93885166 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 CKNS Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 97.18 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(#N)[S-].[K+] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(#N)[S-].[K+] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 24.8 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 96.93885166 4 0 0 0 0 0 0 0 2 -1