Career opportunities within science and technology are seeing unprecedented growth across the world, and those who study chemistry or another natural science at university now have increasingly better career prospects. 18422-53-2, Name is 1,2:4,5-Di-O-Isopropylidene-Beta-D-Erythro-2,3-Hexodiulo-2,6-Pyranose, SMILES is O=C1[C@@]2(OC[C@]3([H])[C@@]1([H])OC(C)(O3)C)OC(C)(OC2)C, belongs to dioxole compound. In a document, author is de Oliveira, Adriano Bof, introduce the new discover, Synthetic Route of 18422-53-2.
In the title compound, C12H15N3O2S, the 1,3-benzdioxole fragment is nearly planar [the maximum deviation being 0.0515 (14) angstrom], the N-N-C(S)-N fragment is also nearly planar [the maximum deviation being 0.0480 (10) angstrom], and the dihedral angle between their mean planes is 23.49 (10)degrees. In the crystal, molecules are linked by pairs of N-H center dot center dot center dot S hydrogen bonds, forming inversion dimers. The dimers are stacked along the a axis with neighbouring columns having the same direction; however, the molecules show different orientations leading to a centrosymmetric arrangement. In the crystal, the methylene group of the ethyl substituent and the terminal methyl H atoms are disordered over two sets of sites and were refined using a split model with an occupancy ratio of 0.5:0.5.
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Reference:
1,3-Benzodioxole – Wikipedia,
,Dioxole | C3H4O2 – PubChem