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17.5885 11.5263 35.775 4.5981 42.7032 12.3923 34.909 3.732 43.5692 13.2583 34.0429 2.866 44.4352 2 45.3013 24.9152 24.1181 23.2521 24.0492 25.0727 25.6927 22.4746 23.0946 25.8502 26.6472 22.3171 21.5201 27.5133 26.7162 20.654 21.4511 27.5822 28.3793 20.5851 19.788 29.2453 28.4483 18.922 19.719 29.3143 30.1113 7.6636 8.4607 9.3267 8.5297 18.853 18.056 7.5947 6.7976 38.8406 39.6376 38.7716 37.9745 40.5036 39.7066 9.3957 10.1928 5.9316 6.7287 37.1085 37.9056 40.5726 41.3697 30.9774 30.1803 11.0588 10.2617 5.8626 5.0656 37.0395 36.2425 42.2357 41.4386 17.1899 17.987 11.1278 11.9248 35.3765 36.1735 4.1996 4.9966 42.3047 43.1017 31.4449 12.7908 11.9938 35.3075 34.5104 4.1306 3.3335 43.9677 43.1707 16.7224 33.1769 12.8598 13.6569 2.4675 3.2646 44.0367 44.8338 14.9904 32.1209 31.1909 32.5009 33.4309 2.31 1.4631 1.69 15.6664 14.7364 16.0464 16.9764 45.6113 45.8382 44.9913 -0.25 0.25 0.25 -0.25 0.25 -1.25 -0.25 0.25 -0.75 0.75 0.616 -1.116 1.116 -0.616 0.25 -0.25 -0.75 0.75 -0.25 0.25 -0.75 0.75 -0.25 0.25 -0.75 -0.25 0.75 0.25 0.25 -0.25 0.25 0.25 -0.25 -0.25 -0.25 -0.25 -0.25 0.25 0.25 0.25 0.25 0.25 -0.25 -0.25 -0.25 -0.25 0.25 0.25 0.25 0.25 -0.25 -0.25 -0.25 -0.25 0.25 0.25 0.7249 0.7249 -0.7249 -0.7249 -0.7869 0.2869 -0.2869 0.7869 -1.225 -1.225 1.225 1.225 0.2249 0.2249 -0.2249 -0.2249 -1.225 -1.225 1.225 1.225 0.2249 0.2249 -0.2249 -0.2249 -1.225 -1.225 -0.7249 -0.7249 0.7249 0.7249 1.225 1.225 0.7249 0.7249 -0.7249 -0.7249 0.7249 0.7249 0.7249 0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 0.2249 0.2249 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 -0.2249 -0.2249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -1.37 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 0.7249 1.37 0.87 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.7249 -0.87 1.153 0.616 -1.653 -1.116 0.7869 0.56 -0.2869 1.653 1.116 -1.153 -0.616 -0.2869 0.56 0.7869 -4 Compound Canonicalized 5 2019.01.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 597 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 10 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 10 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 40 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371F07FF800000000000000000400000000000000000000000000000000000000000000001E00100C00000800E18006020802C0020008000090080000000000000000008108000000401200800014400004100080000198C8A08000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 azanide;6-[2-(6-azanidylhexylammonio)ethylammonio]hexylazanide;1-hydroperoxytetradecane;platinum;tetradecanoic acid IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 azanide;6-[2-(6-azanidylhexylammonio)ethylammonio]hexylazanide;1-hydroperoxytetradecane;platinum;tetradecanoic acid IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 azanide;6-[2-(6-azanidylhexylazaniumyl)ethylazaniumyl]hexylazanide;1-hydroperoxytetradecane;platinum;tetradecanoic acid IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 azanide;6-[2-(6-azanidylhexylazaniumyl)ethylazaniumyl]hexylazanide;1-hydroperoxytetradecane;platinum;tetradecanoic acid IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 azanide;6-[2-(6-azanidylhexylazaniumyl)ethylazaniumyl]hexylazanide;1-(dioxidanyl)tetradecane;platinum;tetradecanoic acid IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 6-[2-(6-amidylhexylammonio)ethylammonio]hexylazanide;azanide;1-hydroperoxytetradecane;myristic acid;platinum InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C14H32N4.C14H30O2.C14H28O2.4H2N.2Pt/c15-9-5-1-3-7-11-17-13-14-18-12-8-4-2-6-10-16;1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-15;1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;;;;;;/h15-18H,1-14H2;15H,2-14H2,1H3;2-13H2,1H3,(H,15,16);4*1H2;;/q-2;;;4*-1;;/p+2 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 LBHTYTNYJOVHSW-UHFFFAOYSA-P Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 1169.714232 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C42H100N8O4Pt2-4 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 1171.5 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CCCCCCCCCCCCCCOO.CCCCCCCCCCCCCC(=O)O.C(CCC[NH2+]CC[NH2+]CCCCCC[NH-])CC[NH-].[NH2-].[NH2-].[NH2-].[NH2-].[Pt].[Pt] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CCCCCCCCCCCCCCOO.CCCCCCCCCCCCCC(=O)O.C(CCC[NH2+]CC[NH2+]CCCCCC[NH-])CC[NH-].[NH2-].[NH2-].[NH2-].[NH2-].[Pt].[Pt] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 106 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 1170.71634 56 0 0 0 0 0 0 0 9 -1