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Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline]
The crystal structures of the title compounds, C(19)H(19)NO and C(31)H(34)N(2)O, were determined as part of an experiment in an undergraduate teaching laboratory that demonstrates the relationship between molecular structure and function. 1′,3′,3′-Trimethylspiro[chromene-2,2′-indoline] is both a...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5095856/ https://www.ncbi.nlm.nih.gov/pubmed/27840731 http://dx.doi.org/10.1107/S2056989016016042 |
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author | Beckett, Joseph O. S. Olmstead, Marilyn M. Fettinger, James C. Gray, David A. Manabe, Shuhei Mascal, Mark |
author_facet | Beckett, Joseph O. S. Olmstead, Marilyn M. Fettinger, James C. Gray, David A. Manabe, Shuhei Mascal, Mark |
author_sort | Beckett, Joseph O. S. |
collection | PubMed |
description | The crystal structures of the title compounds, C(19)H(19)NO and C(31)H(34)N(2)O, were determined as part of an experiment in an undergraduate teaching laboratory that demonstrates the relationship between molecular structure and function. 1′,3′,3′-Trimethylspiro[chromene-2,2′-indoline] is both a photoswitch and thermochromic molecule. Students synthesized it and a bis-indoline adduct and compared the crystallographically determined structures to computed gas-phase models. |
format | Online Article Text |
id | pubmed-5095856 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-50958562016-11-11 Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] Beckett, Joseph O. S. Olmstead, Marilyn M. Fettinger, James C. Gray, David A. Manabe, Shuhei Mascal, Mark Acta Crystallogr E Crystallogr Commun Research Communications The crystal structures of the title compounds, C(19)H(19)NO and C(31)H(34)N(2)O, were determined as part of an experiment in an undergraduate teaching laboratory that demonstrates the relationship between molecular structure and function. 1′,3′,3′-Trimethylspiro[chromene-2,2′-indoline] is both a photoswitch and thermochromic molecule. Students synthesized it and a bis-indoline adduct and compared the crystallographically determined structures to computed gas-phase models. International Union of Crystallography 2016-10-28 /pmc/articles/PMC5095856/ /pubmed/27840731 http://dx.doi.org/10.1107/S2056989016016042 Text en © Beckett et al. 2016 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Beckett, Joseph O. S. Olmstead, Marilyn M. Fettinger, James C. Gray, David A. Manabe, Shuhei Mascal, Mark Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title | Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title_full | Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title_fullStr | Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title_full_unstemmed | Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title_short | Crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(E)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
title_sort | crystal structure determination as part of an undergraduate laboratory experiment: 1′,3′,3′-trimethylspiro[chromene-2,2′-indoline] and 1′,3′,3′-trimethyl-4-[(e)-(1,3,3-trimethylindolin-2-ylidene)methyl]spiro[chroman-2,2′-indoline] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5095856/ https://www.ncbi.nlm.nih.gov/pubmed/27840731 http://dx.doi.org/10.1107/S2056989016016042 |
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