<HashMap><database>biostudies-other</database><scores/><additional><omics_type>Unknown</omics_type><volume>66(Pt 2)</volume><submitter>Akkurt M</submitter><journal>Acta crystallographica. Section E, Structure reports online</journal><pagination>o399-400</pagination><full_dataset_link>https://www.ebi.ac.uk/biostudies/studies/S-EPMC2979878</full_dataset_link><abstract>The title compound, C(14)H(9)ClN(2)OS, crystallizes with two unique mol-ecules, A and B, in the asymmetric unit. The five-membered rings of the benzothia-zole groups in both mol-ecules adopt an envelope conformation [puckering parameters: q(2) = 0.242?(1)?Å and ?(2) = 217.5?(4)° for A, and q(2) = 0.234?(1)?Å and ?(2) = 37.7?(4)° for B]. The five-membered rings of the indolinone groups in both mol-ecules are also not planar, with a twisted conformation [puckering parameters are q(2) = 0.112?(2)?Å and ?(2) = 126.3?(8)° for A, and q(2) = 0.108?(2)?Å and ?(2) = 306.4?(9)° for B]. In the crystal structure, there are inter-molecular N-H?O, N-H?S and C-H?O hydrogen-bonding inter-actions, forming the layers propagating normal to c.</abstract><repository>biostudies-other</repository><pmcid>PMC2979878</pmcid><data_source>Europe PMC</data_source><pubmed_authors>Akkurt M</pubmed_authors><pubmed_authors>Karal? N</pubmed_authors><pubmed_authors>Karaca S</pubmed_authors><pubmed_authors>Buyukgungor O</pubmed_authors><pubmed_authors>Ermut G</pubmed_authors></additional><is_claimable>false</is_claimable><name>5-Chloro-benzothia-zole-2-spiro-3'-indolin-2'-one.</name><description>The title compound, C(14)H(9)ClN(2)OS, crystallizes with two unique mol-ecules, A and B, in the asymmetric unit. The five-membered rings of the benzothia-zole groups in both mol-ecules adopt an envelope conformation [puckering parameters: q(2) = 0.242?(1)?Å and ?(2) = 217.5?(4)° for A, and q(2) = 0.234?(1)?Å and ?(2) = 37.7?(4)° for B]. The five-membered rings of the indolinone groups in both mol-ecules are also not planar, with a twisted conformation [puckering parameters are q(2) = 0.112?(2)?Å and ?(2) = 126.3?(8)° for A, and q(2) = 0.108?(2)?Å and ?(2) = 306.4?(9)° for B]. In the crystal structure, there are inter-molecular N-H?O, N-H?S and C-H?O hydrogen-bonding inter-actions, forming the layers propagating normal to c.</description><dates><release>2010-01-01T00:00:00Z</release><publication>2010 </publication><modification>2019-03-27T00:00:56Z</modification><creation>2019-03-27T00:00:56Z</creation></dates><accession>S-EPMC2979878</accession><cross_references><pubmed>21579820</pubmed><doi>10.1107/S1600536810001285 </doi></cross_references></HashMap>