Cargando…

2-[(2,4,6-Trimethylbenzene)sulfonyl]phthalazin-1(2H)-one: crystal structure, Hirshfeld surface analysis and computational study

The X-ray crystal structure of the title phthalazin-1-one derivative, C(17)H(16)N(2)O(3)S {systematic name: 2-[(2,4,6-trimethylbenzene)sulfonyl]-1,2-dihydrophthalazin-1-one}, features a tetrahedral sulfoxide-S atom, connected to phthalazin-1-one and mesityl residues. The dihedral angle [83.26...

Descripción completa

Detalles Bibliográficos
Autores principales:	Izuogu, David Chukwuma, Asegbeloyin, Jonnie Niyi, Jotani, Mukesh M., Tiekink, Edward R. T.
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/PMC7199273/ https://www.ncbi.nlm.nih.gov/pubmed/32431935 http://dx.doi.org/10.1107/S2056989020005101

Ejemplares similares

7-Methyl-5-[(4-methylbenzene)sulfonyl]-2H,5H-[1,3]dioxolo[4,5-f]indole: crystal structure and Hirshfeld analysis
por: Ali, Akbar, et al.
Publicado: (2018)

rac-2-Phenyl-1-[(2,4,6-triisopropylbenzene)sulfonyl]aziridine
por: Golz, Christopher, et al.
Publicado: (2014)

1,3-Bis[(tert-butylsulfanyl)methyl]-2,4,6-trimethylbenzene
por: Paz-Morales, Evelyn, et al.
Publicado: (2013)

1,3-Bis{[(4-methylphenyl)sulfonyl]oxy}propan-2-yl 4-methylbenzenesulfonate
por: Yusof, Yusrabbil Amiyati, et al.
Publicado: (2012)

5,5′,5′′-Triphenyl-2,2′,2′′-[2,4,6-trimethylbenzene-1,3,5-triyltris(methylidenesulfanediyl)]tris(1,3,4-oxadiazole)
por: Wang, Wei, et al.
Publicado: (2010)

4,4′,4′′-Tris(2-pyridyl)-2,2′,2′′-[(2,4,6-trimethylbenzene-1,3,5-triyl)tris(methylene)tris(sulfanediyl)]tripyrimidine
por: Zhang, Ya-Wen, et al.
Publicado: (2009)

1,3,5-Tris{[3-(1H-benzotriazol-1-ylmethyl)phenoxy]methyl}-2,4,6-trimethylbenzene
por: Xu, Chen, et al.
Publicado: (2008)

2-{[2,8-Bis(trifluoromethyl)quinolin-4-yl](hydroxy)methyl}piperidin-1-ium trichloroacetate: crystal structure and Hirshfeld surface analysis
por: Wardell, James L., et al.
Publicado: (2018)

1-Chloro-4-[2-(4-chlorophenyl)ethyl]benzene and its bromo analogue: crystal structure, Hirshfeld surface analysis and computational chemistry
por: Jotani, Mukesh M., et al.
Publicado: (2019)

Crystal structure of 1-[(2,4,6-triisopropylphenyl)sulfonyl]aziridine
por: Knauer, Lena, et al.
Publicado: (2015)

N′-(1,3-Benzothiazol-2-yl)benzenesulfonohydrazide: crystal structure, Hirshfeld surface analysis and computational chemistry
por: Baddeley, Thomas C., et al.
Publicado: (2019)

Crystal structure and Hirshfeld surface analysis of 2-{[2,8-bis(trifluoromethyl)quinolin-4-yl](hydroxy)methyl}piperidin-1-ium 2-hydroxy-2-phenylacetate hemihydrate
por: Wardell, James L., et al.
Publicado: (2016)

Hydrazinium 2-amino-4-nitrobenzoate dihydrate: crystal structure and Hirshfeld surface analysis
por: Wardell, James L., et al.
Publicado: (2017)

Crystal structure of [2-(triethylammonio)ethyl][(2,4,6-triisopropylphenyl)sulfonyl]amide tetrahydrate
por: Golz, C., et al.
Publicado: (2015)

(μ(2)-Adipato-κ(4) O,O′:O′′,O′′′)bis[aqua(benzene-1,2-diamine-κ(2) N,N′)chloridocadmium]: crystal structure and Hirshfeld surface analysis
por: Rahman, Wannur Sofiasalamah Khairiah A., et al.
Publicado: (2017)

[N-Benzyl-N-(2-phenylethyl)dithiocarbamato-κ(2) S,S′]triphenyltin(IV) and [bis(2-methoxyethyl)dithiocarbamato-κ(2) S,S′]triphenyltin(IV): crystal structures and Hirshfeld surface analysis
por: Mohamad, Rapidah, et al.
Publicado: (2016)

Two dialkylammonium salts of 2-amino-4-nitrobenzoic acid: crystal structures and Hirshfeld surface analysis
por: Wardell, James L., et al.
Publicado: (2016)

N-(2-Formylphenyl)-4-methyl-N-[(4-methylphenyl)sulfonyl]benzenesulfonamide
por: Kim, Sung-Gon
Publicado: (2014)

Crystal structure and Hirshfeld surface analysis of 4-cyano-N-[(4-cyanophenyl)sulfonyl]-N-[2-(5-methylfuran-2-yl)phenyl]benzenesulfonamide
por: Mammadova, Gunay Z., et al.
Publicado: (2023)

Crystal structure and Hirshfeld surface analysis of N-[2-(5-methylfuran-2-yl)phenyl]-3-nitro-N-[(3-nitrophenyl)sulfonyl]benzenesulfonamide
por: Mammadova, Gunay Z., et al.
Publicado: (2023)

4-[(1-Benzyl-1H-1,2,3-triazol-4-yl)methoxy]benzene-1,2-dicarbonitrile: crystal structure, Hirshfeld surface analysis and energy-minimization calculations
por: Shamsudin, Norzianah, et al.
Publicado: (2016)

Crystal structures and Hirshfeld surface analyses of (N-hexyl-N-methyldithiocarbamato-κ(2) S,S′)triphenyltin(IV) and [N-methyl-N-(2-phenylethyl)dithiocarbamato-κ(2) S,S′]triphenyltin(IV)
por: Mohamad, Rapidah, et al.
Publicado: (2018)

A triclinic polymorph of tricyclohexylphosphane sulfide: crystal structure and Hirshfeld surface analysis
por: Tan, Yi Jiun, et al.
Publicado: (2017)

Crystal structure of N′-[(1E)-1-(6-methyl-2,4-dioxo-3,4-dihydro-2H-pyran-3-ylidene)ethyl]benzenesulfonohydrazide
por: Asegbeloyin, Jonnie N., et al.
Publicado: (2014)

2-Carboxyquinolinium–2,4,6-trinitrobenzenesulfonate–quinolinium-2-carboxylate (1/1/1)
por: Smith, Graham, et al.
Publicado: (2007)

Bis[2-(4,5-diphenyl-1H-imidazol-2-yl)-4-nitrophenolato]copper(II) dihydrate: crystal structure and Hirshfeld surface analysis
por: Chettri, Sailesh, et al.
Publicado: (2019)

Bis(mefloquinium) butanedioate ethanol monosolvate: crystal structure and Hirshfeld surface analysis
por: Wardell, James L., et al.
Publicado: (2019)

Methyl 2-(4-acetamidobenzenesulfonamido)benzoate
por: Khan, Islam Ullah, et al.
Publicado: (2011)

3,3-Bis(2-hydroxyethyl)-1-(4-nitrobenzoyl)thiourea: crystal structure, Hirshfeld surface analysis and computational study
por: Tan, Sang Loon, et al.
Publicado: (2020)

N-(6-Methoxypyridin-2-yl)-1-(pyridin-2-ylmethyl)-1H-pyrazole-3-carboxamide: crystal structure and Hirshfeld surface analysis
por: Ramani, Vivek C., et al.
Publicado: (2018)

(N,N-Diisopropyldithiocarbamato)triphenyltin(IV): crystal structure, Hirshfeld surface analysis and computational study
por: Haezam, Farah Natasha, et al.
Publicado: (2019)

N′-[1-(5-Bromo-2-hydroxyphenyl)ethylidene]isonicotinohydrazide monohydrate: crystal structure and Hirshfeld surface analysis
por: Lee, See Mun, et al.
Publicado: (2017)

(N,N-Diallyldithiocarbamato-κ(2) S,S′)triphenyltin(IV) and bis(N,N-diallyldithiocarbamato-κ(2) S,S′)diphenyltin(IV): crystal structure, Hirshfeld surface analysis and computational study
por: Haezam, Farah Natasha, et al.
Publicado: (2020)

Crystal structures and Hirshfeld surface analyses of bis[N,N-bis(2-methoxyethyl)dithiocarbamato-κ(2) S,S′]di-n-butyltin(IV) and [N-(2-methoxyethyl)-N-methyldithiocarbamato-κ(2) S,S′]triphenyltin(IV)
por: Mohamad, Rapidah, et al.
Publicado: (2018)

A 2:1 co-crystal of 2-methylbenzoic acid and N,N′-bis(pyridin-4-ylmethyl)ethanediamide: crystal structure and Hirshfeld surface analysis
por: Syed, Sabrina, et al.
Publicado: (2016)

1,3,5-Trifluoro-2,4,6-triiodobenzene–piperazine (2/1)
por: Hajjar, Christelle, et al.
Publicado: (2021)

N-{[4-(4-Methoxybenzenesulfonamido)phenyl]sulfonyl}acetamide
por: Mustafa, Ghulam, et al.
Publicado: (2010)

New monoclinic form of {O-Ethyl N-(4-nitrophenyl)thiocarbamato-κS}(tri-4-tolylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis
por: Kuan, Fong Sheen, et al.
Publicado: (2017)

(2Z)-3-Hydroxy-1-(pyridin-2-yl)-3-(pyridin-3-yl)prop-2-en-1-one: crystal structure and Hirshfeld surface analysis
por: Lee, Sze-Ling, et al.
Publicado: (2016)

Di-n-butylbis[N-(2-methoxyethyl)-N-methyldithiocarbamato-κ(2) S,S′]tin(IV): crystal structure and Hirshfeld surface analysis
por: Mohamad, Rapidah, et al.
Publicado: (2017)

Cannot write session to /tmp/vufind_sessions/sess_12b80iu8utpubiaegbm91dkmeb