407212 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 27 17 17 7 7 7 7 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 4 -1 5 -1 6 -1 7 -1 1 1 1 1 1 1 4 4 5 5 6 6 7 7 8 8 8 9 9 10 10 10 11 11 2 3 4 5 6 7 8 12 9 13 10 14 11 15 9 16 17 18 19 11 20 21 22 23 1 1 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 3.3987 3.1231 3.6743 2.5896 4.2077 4.2077 2.5896 2.8987 3.8987 3.8987 2.8987 2 4.7973 4.7973 2 2.9635 2.2922 4.5051 3.8339 3.8339 4.5051 2.2922 2.9635 0 -0.9613 -0.9613 0.5878 0.5878 -0.5878 -0.5878 1.5388 1.5388 -1.5388 -1.5388 0.3962 0.3962 -0.3962 -0.3962 2.1554 1.6678 1.6678 2.1554 -2.1554 -1.6678 -1.6678 -2.1554 -4 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 35.3 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 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 00000371C0638000060000100000000000000000000162C00000000000000000000000000000001C00100000000000C100040000004000000000000000000000000000000000800000000040000000000000000010000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-azanidylethylazanide;dichlorocobalt IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-azanidylethylazanide;dichlorocobalt IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-azanidylethylazanide;dichlorocobalt IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-azanidylethylazanide;dichlorocobalt IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-azanidylethylazanide;bis(chloranyl)cobalt IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 2-amidylethylazanide;dichlorocobalt InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/2C2H6N2.2ClH.Co/c2*3-1-2-4;;;/h2*3-4H,1-2H2;2*1H;/q2*-2;;;+2/p-2 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 LBGRXLRZGLIOLI-UHFFFAOYSA-L Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 244.977095 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C4H12Cl2CoN4-4 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 246.00 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(C[NH-])[NH-].C(C[NH-])[NH-].Cl[Co]Cl SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(C[NH-])[NH-].C(C[NH-])[NH-].Cl[Co]Cl Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 244.977095 11 0 0 0 0 0 0 0 3 1