Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate
In the title compound, C12H11NO4, the dihedral angle between the indole ring system (r.m.s. deviation = 0.019 Å) and the oxirane ring is 88.8 (2)°. The oxirane O atom and the bridging ester O atom are in an approximate syn conformation [O—C—C—O = −25.4 (3)°] In the crystal, inversion dimers linked b...
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International Union of Crystallography
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doaj-6513f3c4251d46129ccf116c93b4d0642020-11-25T00:33:05ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-05-01715o274o27510.1107/S2056989015006398hb7369Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylateM. P. Savithri0P. S. Yuvaraj1B. S. R. Reddy2R. Raja3A. SubbiahPandi4Department of Physics, Queen Mary's College (Autonomous), Chennai 600 004, IndiaUniversity of Madras, Industrial Chemistry Laboratory, Central Leather Research Institute, Adyar, Chennai 600 020, IndiaUniversity of Madras, Industrial Chemistry Laboratory, Central Leather Research Institute, Adyar, Chennai 600 020, IndiaDepartment of Physics, Presidency College (Autonomous), Chennai 600 005, IndiaDepartment of Physics, Presidency College (Autonomous), Chennai 600 005, IndiaIn the title compound, C12H11NO4, the dihedral angle between the indole ring system (r.m.s. deviation = 0.019 Å) and the oxirane ring is 88.8 (2)°. The oxirane O atom and the bridging ester O atom are in an approximate syn conformation [O—C—C—O = −25.4 (3)°] In the crystal, inversion dimers linked by pair of C—H...O hydrogen bonds generate R22(8) loops, where the C—H donor group forms part of the oxirane ring. A second C—H...O interaction arising from one of the C—H groups of the benzene ring links the dimers into [001] double chains.http://scripts.iucr.org/cgi-bin/paper?S2056989015006398crystal structureesterspiro compoundindolineoxiranehydrogen bonding |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
M. P. Savithri P. S. Yuvaraj B. S. R. Reddy R. Raja A. SubbiahPandi |
spellingShingle |
M. P. Savithri P. S. Yuvaraj B. S. R. Reddy R. Raja A. SubbiahPandi Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate Acta Crystallographica Section E: Crystallographic Communications crystal structure ester spiro compound indoline oxirane hydrogen bonding |
author_facet |
M. P. Savithri P. S. Yuvaraj B. S. R. Reddy R. Raja A. SubbiahPandi |
author_sort |
M. P. Savithri |
title |
Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
title_short |
Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
title_full |
Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
title_fullStr |
Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
title_full_unstemmed |
Crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
title_sort |
crystal structure of methyl 1-methyl-2-oxospiro[indoline-3,2′-oxirane]-3′-carboxylate |
publisher |
International Union of Crystallography |
series |
Acta Crystallographica Section E: Crystallographic Communications |
issn |
2056-9890 |
publishDate |
2015-05-01 |
description |
In the title compound, C12H11NO4, the dihedral angle between the indole ring system (r.m.s. deviation = 0.019 Å) and the oxirane ring is 88.8 (2)°. The oxirane O atom and the bridging ester O atom are in an approximate syn conformation [O—C—C—O = −25.4 (3)°] In the crystal, inversion dimers linked by pair of C—H...O hydrogen bonds generate R22(8) loops, where the C—H donor group forms part of the oxirane ring. A second C—H...O interaction arising from one of the C—H groups of the benzene ring links the dimers into [001] double chains. |
topic |
crystal structure ester spiro compound indoline oxirane hydrogen bonding |
url |
http://scripts.iucr.org/cgi-bin/paper?S2056989015006398 |
work_keys_str_mv |
AT mpsavithri crystalstructureofmethyl1methyl2oxospiroindoline32oxirane3carboxylate AT psyuvaraj crystalstructureofmethyl1methyl2oxospiroindoline32oxirane3carboxylate AT bsrreddy crystalstructureofmethyl1methyl2oxospiroindoline32oxirane3carboxylate AT rraja crystalstructureofmethyl1methyl2oxospiroindoline32oxirane3carboxylate AT asubbiahpandi crystalstructureofmethyl1methyl2oxospiroindoline32oxirane3carboxylate |
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1725317251077242880 |