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Gaussian Job Archive for C19H23NaO7S
Archive of work produced using the resources of the Imperial College High Performance Computing Service.
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InChI=1/C19H24O7S.Na/c1-18-12-14(17(20)21)15-9-11-24-19(18,25-15)10-5-8-16(18)26-27(22,23)13-6-3-2-4-7-13;/h2-4,6-7,14-16H,5,8-12H2,1H3,(H,20,21);/q;+1/p-1/t14-,15-,16+,18-,19-;/m0./s1InChIKey=YYCQPHKFJQVHEZ-NZGVZAPVSA-MC1C[C@]23O[C@H]([C@H](C[C@@]2(C)[C@@H](OS(=O)(c2ccccc2)=O)C1)C(=O)O[Na])CCO3C19H23NaO7SFreqwB97XD/6-311G(d,p)scrf=(cpcm,solvent=chloroform)geom=connectiOrganic Chemistry
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