Crystal structure of rac-(3a'R,9a'R)-3a'-(indol-3-yl)-1#8242;,2#8242;,3#8242;,3a',4#8242;,9a'-hexa#173;hydro#173;spiro#173;cyclo#173;pentane-1,9#8242;-penta#173;leno1,2-bindole p-xylene hemisolvate

Noland W.E.; Worth M.A.; Schneerer A.K.Paal C.L.Tritch K.J.

首页> 外文期刊>Acta Crystallographica Section E: Crystallographic Communications >Crystal structure of rac-(3a'R,9a'R)-3a'-(indol-3-yl)-1#8242;,2#8242;,3#8242;,3a',4#8242;,9a'-hexa#173;hydro#173;spiro#173;cyclo#173;pentane-1,9#8242;-penta#173;leno1,2-bindole p-xylene hemisolvate

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Crystal structure of rac-(3a'R,9a'R)-3a'-(indol-3-yl)-1#8242;,2#8242;,3#8242;,3a',4#8242;,9a'-hexa#173;hydro#173;spiro#173;cyclo#173;pentane-1,9#8242;-penta#173;leno1,2-bindole p-xylene hemisolvate

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The title compound, C26H26N2#183;0.5C8H10, is the first reported characterized 2:2 product from acid-catalyzed condensation of indole with cyclo#173;penta#173;none and no other 2:2 products were observed. Recrystallization from p-xylene gave the title hemisolvate with the p-xylene mol#173;ecule located about an inversion center. The terminal penta#173;lene ring is envelope-flap disordered at the C atom farthest from the skeletal indole unit, with a refined occupancy ratio of 0.819#8197;(4):0.181#8197;(4). The major component has this C atom bent away from the spiro-fused cyclo#173;pentane ring. In the crystal, mol#173;ecules are connected by N#8212;H#8943;#960; inter#173;actions, forming chains along 100, and N#8212;H#8943;#960; and C#8212;H#8943;#960; inter#173;actions, forming chains along 001, which results in the formation of slabs parallel to (010).

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来源
《Acta Crystallographica Section E: Crystallographic Communications》 |2015年第5期|516-519|共4页
作者
Noland W.E.; Worth M.A.; Schneerer A.K.Paal C.L.Tritch K.J.;
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Department of Chemistry, University of Minnesota, Minneapolis, MN 55455-0431, USA;

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正文语种英语
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CRYSTAL STRUCTURE; ANNULATION; INDOLE; CYCLIC KETONE; DISORDER; X-H...PI INTERACTIONS;

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外文文献

1. Crystal structure of rac-(3a'R,9a'R)-3a'-(indol-3-yl)-1′,2′,3′,3a',4′,9a'-hexahydrospiro[cyclopentane-1,9′-pentaleno[1,2-b]indole] p-xylene hemisolvate [O] . Wayland E. Noland, Matthew A. Worth, Andrew K. Schneerer, 2015

机译：rac-（3a'R，9a'R）-3a' - （吲哚-3-基）-1'，2'，3'，3a'，4'，9a'-六氢螺[环戊烷-1]的晶体结构， 9'-戊二酰[1,2-b]吲哚]对二甲苯半溶剂化物

Crystal structure of rac-(3a'R,9a'R)-3a'-(indol-3-yl)-1#8242;,2#8242;,3#8242;,3a',4#8242;,9a'-hexa#173;hydro#173;spiro#173;cyclo#173;pentane-1,9#8242;-penta#173;leno1,2-bindole p-xylene hemisolvate

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