Cargando…

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 2-(2,3-dihydro-1H-perimidin-2-yl)-6-methoxyphenol

The title compound, C(18)H(16)N(2)O(2), consists of perimidine and methoxyphenol units, where the tricyclic perimidine unit contains a naphthalene ring system and a non-planar C(4)N(2) ring adopting an envelope conformation with the NCN group hinged by 47.44 (7)° with respect to the best plane of...

Descripción completa

Detalles Bibliográficos
Autores principales:	Daouda, Ballo, Tuo, Nanou Tiéba, Hökelek, Tuncer, Niameke Jean-Baptiste, Kangah, Charles Guillaume, Kodjo, Claude, Kablan Ahmont Landry, Essassi, El Mokhtar
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	International Union of Crystallography 2020
Materias:	Research Communications
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7199263/ https://www.ncbi.nlm.nih.gov/pubmed/32431917 http://dx.doi.org/10.1107/S2056989020004284

Ejemplares similares

Crystal structure, Hirshfeld surface analysis and DFT studies of 2-(2,3-dihydro-1H-perimidin-2-yl)phenol
por: Daouda, Ballo, et al.
Publicado: (2020)

2,2-Dimethyl-2,3-dihydro-1H-perimidine
por: Maloney, Sarah, et al.
Publicado: (2013)

Crystal structure and Hirshfeld surface analysis of 1-benzyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-2-one
por: Saber, Asmaa, et al.
Publicado: (2018)

Crystal structure, Hirshfeld surface analysis and DFT study of (2Z)-2-(4-fluorobenzylidene)-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-3-one
por: Hni, Brahim, et al.
Publicado: (2019)

Crystal structure and Hirshfeld surface analysis of 3,4-dihydro-2-(2,4-dioxo-6-methylpyran-3-ylidene)-4-(4-pyridin-4-yl)-1,5-benzodiazepine
por: El Ghayati, Lhoussaine, et al.
Publicado: (2019)

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 1-methyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-2-one
por: Saber, Asmaa, et al.
Publicado: (2019)

Crystal structure and Hirshfeld surface analysis of 1-{[2-oxo-3-(prop-1-en-2-yl)-2,3-dihydro-1H-1,3-benzodiazol-1-yl]methyl}-3-(prop-1-en-2-yl)-2,3-dihydro-1H-1,3-benzodiazol-2-one
por: Saber, Asmaa, et al.
Publicado: (2018)

Crystal structure, Hirshfeld surface analysis, interaction energy and DFT studies of (2Z)-2-(2,4-dichlorobenzylidene)-4-nonyl-3,4-dihydro-2H-1,4-benzothiazin-3-one
por: Hni, Brahim, et al.
Publicado: (2020)

Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of ethyl 2-[(2Z)-2-(2-chlorobenzylidene)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate
por: Sebbar, Ghizlane, et al.
Publicado: (2020)

Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 1-decyl-2,3-dihydro-1H-benzimidazol-2-one
por: Ait Elmachkouri, Younesse, et al.
Publicado: (2021)

1-Allyl-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-2-one
por: Ballo, Daouda, et al.
Publicado: (2010)

Ethyl 2-(2-oxo-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)acetate
por: Ballo, Daouda, et al.
Publicado: (2010)

Crystal structure, Hirshfeld surface analysis and DFT study of (2Z)-2-(2,4-dichlorobenzylidene)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one
por: Hni, Brahim, et al.
Publicado: (2019)

Crystal structure, Hirshfeld surface analysis and DFT studies of 1-benzyl-3-[(1-benzyl-1H-1,2,3-triazol-5-yl)methyl]-2,3-dihydro-1H-1,3-benzodiazol-2-one monohydrate
por: Saber, Asmaa, et al.
Publicado: (2020)

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 3-{(2Z)-2-[(2,4-dichlorophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl}propanenitrile
por: Sebbar, Nada Kheira, et al.
Publicado: (2019)

Synthesis, crystal structure and Hirshfeld surface analysis of 3-(4,4-dimethyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-ylidene)-6-methyl-3,4-dihydro-2H-pyran-2,4-dione
por: Samba, Mohamed, et al.
Publicado: (2019)

Chemical Variability and In Vitro Anti-Inflammatory Activity of Leaf Essential Oil from Ivorian Isolona dewevrei (De Wild. & T. Durand) Engl. & Diels
por: Kambiré, Didjour Albert, et al.
Publicado: (2021)

Crystal structure and Hirshfeld surface analysis of 5-methyl-1,2,4-triazolo[1,5-a]pyrimidine
por: Lahmidi, Sanae, et al.
Publicado: (2018)

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 1-(1,3-benzothiazol-2-yl)-3-(2-hydroxyethyl)imidazolidin-2-one
por: Srhir, Mohamed, et al.
Publicado: (2020)

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of (S)-10-propargylpyrrolo[2,1-c][1,4]benzodiazepine-5,11-dione
por: Jeroundi, Dounia, et al.
Publicado: (2020)

Crystal structure, DFT study and Hirshfeld surface analysis of 1-nonyl-2,3-dihydro-1H-indole-2,3-dione
por: Rayni, Ibtissam, et al.
Publicado: (2019)

Crystal structure and Hirshfeld surface analysis of (4Z)-1-butyl-4-(2-oxopropylidene)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one
por: Chkirate, Karim, et al.
Publicado: (2018)

Crystal structure and Hirshfeld surface analysis of ethyl 2-{4-[(3-methyl-2-oxo-1,2-dihydroquinoxalin-1-yl)methyl]-1H-1,2,3-triazol-1-yl}acetate
por: Abad, Nadeem, et al.
Publicado: (2018)

Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of (2Z)-4-benzyl-2-(2,4-dichlorobenzylidene)-2H-1,4-benzothiazin-3(4H)-one
por: Sebbar, Nada Kheira, et al.
Publicado: (2019)

Crystal structure and Hirshfeld surface analysis of 1-[(1-butyl-1H-1,2,3-triazol-4-yl)methyl]-3-methylquinoxalin-2(1H)-one
por: Abad, Nadeem, et al.
Publicado: (2018)

Crystal structure, Hirshfeld surface analysis and DFT calculations of (E)-3-[1-(2-hydroxyphenylanilino)ethylidene]-6-methylpyran-2,4-dione
por: Faraj, Imane, et al.
Publicado: (2022)

Crystal structure, Hirshfeld surface analysis and interaction energy, DFT and antibacterial activity studies of (Z)-4-hexyl-2-(4-methylbenzylidene)-2H-benzo[b][1,4]thiazin-3(4H)-one
por: Sebbar, Ghizlane, et al.
Publicado: (2020)

Crystal structure, Hirshfeld surface analysis, interaction energy and DFT calculations and energy frameworks of methyl 6-chloro-1-methyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
por: Filali Baba, Yassir, et al.
Publicado: (2022)

3-{2-[(3-Phenylquinoxalin-2-yl)oxy]ethyl}-1,3-oxazolidin-2-one
por: Daouda, Ballo, et al.
Publicado: (2011)

3-[2-(3-Phenyl-2-oxo-1,2-dihydroquinoxalin-1-yl)ethyl]-1,3-oxazolidin-2-one
por: Daouda, Ballo, et al.
Publicado: (2013)

3-[2-(3-Methylquinoxalin-2-yloxy)ethyl]-1,3-oxazolidin-2-one
por: Ahoya, Caleb Anothane, et al.
Publicado: (2010)

Crystal structure, Hirshfeld surface analysis and interaction energy calculation of 4-(furan-2-yl)-2-(6-methyl-2,4-dioxopyran-3-ylidene)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
por: El Hafi, Mohamed, et al.
Publicado: (2021)

1-[2-(2-Oxo-1,3-oxazolidin-3-yl)ethyl]-4-phenyl-1H-1,5-benzodiazepin-2(3H)-one
por: Ballo, Daouda, et al.
Publicado: (2010)

Dimethyl 2-methyl-1,2-dihydroquinoline-2,4-dicarboxylate
por: Gültekin, Zeynep, et al.
Publicado: (2011)

Crystal structure and Hirshfeld surface analysis of a new benzodiazepine derivative: 4-dichloromethyl-2,3-dihydro-1H-1,5-benzodiazepin-2-one
por: Chkirate, Karim, et al.
Publicado: (2019)

2-(5,6-Dihydrobenzimidazo[1,2-c]quinazolin-6-yl)-5-methoxyphenol
por: Eltayeb, Naser Eltaher, et al.
Publicado: (2011)

Syntheses and crystal structures of 2-(p-tolyl)-1H-perimidine hemihydrate and 1-methyl-2-(p-tolyl)-1H-perimidine
por: Kalle, Paulina, et al.
Publicado: (2022)

Crystal structure of (E)-2-(4-methoxystyryl)-2,3-dihydro-1H-perimidine acetonitrile monosolvate
por: Manimekalai, A., et al.
Publicado: (2014)

1-Phenyl-3H-2,3-benzodiazepin-4(5H)-one
por: Daouda, Ballo, et al.
Publicado: (2012)

1-Benzyl-3-[(dimethylamino)methylene]-4-phenyl-1H-1,5-benzodiazepine-2(3H)-thione
por: Ballo, Daouda, et al.
Publicado: (2010)

Cannot write session to /tmp/vufind_sessions/sess_u3b7qpb1iccnoh5dhdeibg85i6