Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate)
In the title compound, C29H25FN2O4, the mean planes of the indole ring systems (r.m.s. deviations = 0.0107 and 0.0158 Å) are approximately perpendicular to each other, subtending a dihedral angle of 87.43 (16)°. The 4-fluorophenyl ring is twisted by 77.6 (2) and 83.0 (2)° with respect to the two ind...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2019-02-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314619001342 |
| _version_ | 1828969268612431872 |
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| author | Yu-Long Li Jin Zhou Kai-Long Zhong Xing-Hao Shi Zhi-Yuan Zhang Hong Jiang Hong-Shun Sun |
| author_facet | Yu-Long Li Jin Zhou Kai-Long Zhong Xing-Hao Shi Zhi-Yuan Zhang Hong Jiang Hong-Shun Sun |
| author_sort | Yu-Long Li |
| collection | DOAJ |
| description | In the title compound, C29H25FN2O4, the mean planes of the indole ring systems (r.m.s. deviations = 0.0107 and 0.0158 Å) are approximately perpendicular to each other, subtending a dihedral angle of 87.43 (16)°. The 4-fluorophenyl ring is twisted by 77.6 (2) and 83.0 (2)° with respect to the two indole ring systems. In the crystal, molecules are linked by N—H...O hydrogen bonds, forming layers parallel to the (001) plane. The layers are linked by C—H...π interactions, forming a supramolecular three-dimensional network. |
| first_indexed | 2024-12-14T12:28:30Z |
| format | Article |
| id | doaj.art-1e9ed13ebbba4f9780380768e34b4952 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-14T12:28:30Z |
| publishDate | 2019-02-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-1e9ed13ebbba4f9780380768e34b49522022-12-21T23:01:15ZengInternational Union of CrystallographyIUCrData2414-31462019-02-0142x19013410.1107/S2414314619001342su5473Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate)Yu-Long Li0Jin Zhou1Kai-Long Zhong2Xing-Hao Shi3Zhi-Yuan Zhang4Hong Jiang5Hong-Shun Sun6Targeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaTargeted MRI Contrast Agents Laboratory of Jiangsu Province, Nanjing Polytechnic Institute, Nanjing 210048, People's Republic of ChinaIn the title compound, C29H25FN2O4, the mean planes of the indole ring systems (r.m.s. deviations = 0.0107 and 0.0158 Å) are approximately perpendicular to each other, subtending a dihedral angle of 87.43 (16)°. The 4-fluorophenyl ring is twisted by 77.6 (2) and 83.0 (2)° with respect to the two indole ring systems. In the crystal, molecules are linked by N—H...O hydrogen bonds, forming layers parallel to the (001) plane. The layers are linked by C—H...π interactions, forming a supramolecular three-dimensional network.http://scripts.iucr.org/cgi-bin/paper?S2414314619001342crystal structurebisindoleMRIcontrast agentshydrogen bondingC—H...π interactions |
| spellingShingle | Yu-Long Li Jin Zhou Kai-Long Zhong Xing-Hao Shi Zhi-Yuan Zhang Hong Jiang Hong-Shun Sun Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) IUCrData crystal structure bisindole MRI contrast agents hydrogen bonding C—H...π interactions |
| title | Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) |
| title_full | Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) |
| title_fullStr | Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) |
| title_full_unstemmed | Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) |
| title_short | Diethyl 3,3′-[(4-fluorophenyl)methylidene]bis(1H-indole-2-carboxylate) |
| title_sort | diethyl 3 3 4 fluorophenyl methylidene bis 1h indole 2 carboxylate |
| topic | crystal structure bisindole MRI contrast agents hydrogen bonding C—H...π interactions |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314619001342 |
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