Published July 12, 2019 | Version v1
Publication Open

Crystal structure, DFT study and Hirshfeld surface analysis of 1-nonyl-2,3-dihydro-1<i>H</i>-indole-2,3-dione

Creators

  • 1. Mohammed V University
  • 2. Peoples' Friendship University of Russia
  • 3. Chung Shan Medical University Hospital
  • 4. Chung Shan Medical University
  • 5. Tulane University

Description

In the title mol-ecule, C17H23NO2, the di-hydro-indole portion is planar (r.m.s. deviation = 0.0157 Å) and the nonyl substituent is in an 'extended' conformation. In the crystal, the nonyl chains inter-calate and the di-hydro-indole-dione units are associated through C-H⋯O hydrogen bonds to form micellar blocks. Based on the Hirshfeld surface analysis, the most important inter-molecular inter-action is the H⋯H inter-action.

⚠️ This is an automatic machine translation with an accuracy of 90-95%

Translated Description (Arabic)

في عنوان mol - ecule، C17H23NO2، يكون جزء ثنائي هيدرو إندول مستويًا (انحراف RMS = 0.0157 Å) ويكون بديل نونيل في شكل "ممتد". في البلورة، ترتبط سلاسل نونيل بين الكالات ووحدات دي- هيدرو- إندول- ديون من خلال روابط هيدروجينية C - H - O لتشكيل كتل ميسيلارية. بناءً على تحليل سطح هيرشفيلد، فإن أهم تفاعل بين الجزيئات هو تفاعلHH.

Translated Description (French)

Dans le titre mol-ecule, C17H23NO2, la partie di-hydro-indole est plane (déviation r.m.s. = 0,0157 Å) et le substituant nonyle est dans une conformation « étendue ». Dans le cristal, les chaînes nonyle intercalées et les unités di-hydro-indole-dione sont associées par l'intermédiaire de liaisons hydrogène C-H-O pour former des blocs micellaires. Sur la base de l'analyse de surface de Hirshfeld, l'interaction inter-moléculaire la plus importante est l'interaction H ‹ H.

Translated Description (Spanish)

En el mol-ecuela del título, C17H23NO2, la porción de di-hidro-indol es plana (desviación r.m.s. = 0.0157 Å) y el sustituyente nonilo está en una conformación 'extendida'. En el cristal, las cadenas de nonilo intercaladas y las unidades de di-hidro-indol-diona se asocian a través de enlaces de hidrógeno C-H-O para formar bloques micelares. Con base en el análisis de la superficie de Hirshfeld, la interacción intermolecular más importante es la interacción H.

Files

vm2219.pdf.pdf

Files (721.3 kB)

⚠️ Please wait a few minutes before your translated files are ready ⚠️ Note: Some files might be protected thus translations might not work.
Name Size Download all
md5:97febb849668bf9a14a405d561cb4e70
721.3 kB
Preview Download

Additional details

Additional titles

Translated title (Arabic)
البنية البلورية، دراسة DFT وتحليل سطح Hirshfeld لـ 1 - nonyl -2,3 - dihydro -1<i> H - indole -2,3</i> - dione
Translated title (French)
Structure cristalline, étude DFT et analyse de surface Hirshfeld de la 1-nonyl-2,3-dihydro-1<i>H</i>-indole-2,3-dione
Translated title (Spanish)
Estructura cristalina, estudio DFT y análisis de superficie de Hirshfeld de 1-nonil-2,3-dihidro-1<i>H</i>-indol-2,3-diona

Identifiers

Other
https://openalex.org/W2962286316
DOI
10.1107/s2056989019009691

Is supplement to
https://openalex.org/W4205815930 (Other)
https://openalex.org/W3025587402 (Other)
https://openalex.org/W2340553995 (Other)
https://openalex.org/W2142401223 (Other)
https://openalex.org/W2137366329 (Other)
https://openalex.org/W2131677795 (Other)
https://openalex.org/W2030574793 (Other)
https://openalex.org/W2023799671 (Other)
https://openalex.org/W1974821220 (Other)
https://openalex.org/W1580507190 (Other)

GreSIS Basics Section

Is Global South Knowledge
Yes
Country
Morocco

References

  • https://openalex.org/W118238767
  • https://openalex.org/W1966729465
  • https://openalex.org/W1968339413
  • https://openalex.org/W1969360633
  • https://openalex.org/W1973574058
  • https://openalex.org/W1973851477
  • https://openalex.org/W1984614201
  • https://openalex.org/W1988091937
  • https://openalex.org/W2012488984
  • https://openalex.org/W2023271753
  • https://openalex.org/W2023844571
  • https://openalex.org/W2026945100
  • https://openalex.org/W2028469266
  • https://openalex.org/W2050627980
  • https://openalex.org/W2054759209
  • https://openalex.org/W2094504350
  • https://openalex.org/W2097303062
  • https://openalex.org/W2098949319
  • https://openalex.org/W2101547779
  • https://openalex.org/W2122698005
  • https://openalex.org/W2128788119
  • https://openalex.org/W2132454074
  • https://openalex.org/W2143981217
  • https://openalex.org/W2169678694
  • https://openalex.org/W2172564621
  • https://openalex.org/W2319902168
  • https://openalex.org/W2339613181
  • https://openalex.org/W2465922241
  • https://openalex.org/W2901245062
  • https://openalex.org/W2904785925
  • https://openalex.org/W2950887203
  • https://openalex.org/W2951529432
  • https://openalex.org/W946205963