Supramolecular self-assembly of a new multi-conformational Schiff base through hydrogen bonds: Crystal structure, spectroscopic and theoretical investigation

Mostrar todas las versiones(2)

The compound 4-(4-dimethylaminobenzylidene)aminoacetophenone was synthesized by condensation of 4-aminoacetophenone and 4-(dimethylamino) benzaldehyde in ethanol. This compound was characterized by CG-MS, infrared, Raman, UV–Vis, 1H and 13C NMR spectroscopy. The crystal structure was solved by singl...

Descripción completa

Guardado en:

Detalles Bibliográficos
Autores principales:	Rocha, M., Di Santo, A., Echeverría, G.A., Piro, O.E., Cukiernik, F.D., Ulic, S.E., Gil, D.M.
Formato:	JOUR
Materias:	Crystal structure Hirshfeld surface analysis IR and Raman spectroscopy Mesomorphic properties Quantum chemical calculations Schiff bases Chemical analysis Chemical bonds Differential scanning calorimetry Geometry Hydrogen bonds Nuclear magnetic resonance spectroscopy Quantum chemistry Self assembly Single crystals Surface analysis X ray diffraction Hirshfeld surfaces Mesomorphic property Schiff basis
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_00222860_v1133_n_p24_Rocha
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

Ejemplares similares

Supramolecular self-assembly of a new multi-conformational Schiff base through hydrogen bonds: Crystal structure, spectroscopic and theoretical investigation
por: Cukiernik, Fabio Daniel
Publicado: (2017)

Supramolecular self-assembly of a new multi-conformational Schiff base through hydrogen bonds: Crystal structure, spectroscopic and theoretical investigation
por: Rocha, Mariana, et al.
Publicado: (2017)

A detailed exploration of intermolecular interactions in 4-(4-dimethylaminobenzylideneamino)-N-(5-methyl-3-isoxazolyl) benzenesulfonamide and related Schiff bases: Crystal structure, spectral studies, DFT methods, Pixel energies and Hirshfeld surface analysis
por: Gil, Diego M., et al.
Publicado: (2017)

A combined experimental and theoretical study of the supramolecular self-assembly of the natural benzopyran 2,2-dimethyl-3-hydroxy-6-acetyl-chromane and its isomeric benzofuran 10,11-dihydro-10-hydroxytremetone
por: Gil, Diego M., et al.
Publicado: (2017)

Synthesis and structural study of 2-(haloalkyl)-3-methylchromones
por: Alcívar León, Christian David, et al.
Publicado: (2019)

Synthesis, Experimental and Theoretical Study of Azidochromones
por: Nárvaez Ordóñez, Ena Gabriela, et al.
Publicado: (2022)

Role of weak C—H…O and strong N—H…O intermolecular interactions on the high-symmetry molecular packing of trans-cyclohexane-1,4-dicarboxamide
por: García Reyes, Fernando, et al.
Publicado: (2018)

Role of weak C—H…O and strong N—H…O intermolecular interactions on the high-symmetry molecular packing of trans-cyclohexane-1,4-dicarboxamide
Publicado: (2018)

Role of weak C—H…O and strong N—H…O intermolecular interactions on the high-symmetry molecular packing of trans-cyclohexane-1,4-dicarboxamide
por: Garcí-Reyes, F., et al.

A combined experimental and theoretical study of the tautomeric and conformational properties of (5-phenyl-tetrazol-2-yl)-acetic acid methyl ester
por: Saeed, Aamer, et al.
Publicado: (2015)

Synthesis and characterization of a series of isoniazid hydrazones : Spectroscopic and theoretical study
por: Ferraresi Curotto, Verónica, et al.
Publicado: (2017)

Crystallographic and computational study of a network composed of [ZnCl4]2- anions and triply protonated 4′-functionalized terpyridine cations
Publicado: (2017)

Crystallographic and computational study of a network composed of [ZnCl4]2- anions and triply protonated 4′-functionalized terpyridine cations
por: Granifo, J., et al.

Synthesis, X-ray crystal structure, thermal behavior and spectroscopic analysis of 1-(1-naphthoyl)-3-(halo-phenyl)-thioureas complemented with quantum chemical calculations
por: Saeed, Aamer, et al.
Publicado: (2015)

Understanding the conformational changes and molecular structure of furoyl thioureas upon substitution
por: Ramos Cairo, Raúl, et al.
Publicado: (2017)

Synthesis, characterization and crystal structure of 2-chloroethyl(methylsulfonyl)methanesulfonate
por: Galván, Jorge Edgardo, et al.
Publicado: (2018)

The enrichment ratio of atomic contacts in the crystal structure of isomeric, triply protonated, 4′-functionalized terpyridine cations with [ZnCl4]2- as counter-ion
Publicado: (2018)

The enrichment ratio of atomic contacts in the crystal structure of isomeric, triply protonated, 4′-functionalized terpyridine cations with [ZnCl4]2- as counter-ion
por: Granifo, J., et al.

Theoretical and experimental study of a new thiosulfonate derivative: Methyl trifluoromethanethiosulfonate, CF<sub>3</sub>SO<sub>2</sub>SCH<sub>3</sub>. : Conformational transferability in CX<sub>3</sub>SO<sub>2</sub>S-R compounds
por: Galván, J E., et al.
Publicado: (2017)

On the roles of close shell interactions in the structure of acyl-substituted hydrazones: An experimental and theoretical approach
por: Saeed, Aamer, et al.
Publicado: (2016)

Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives
por: Espitia Cogollo, Edeimis, et al.
Publicado: (2020)

Crystal and molecular structure determination, TGA-DTA, and infrared and Raman spectra of rubidium nitroprusside, Rb<SUB>2</SUB>[Fe(CN)<SUB>5</SUB>NO]
por: Soria, Delia Beatriz, et al.
Publicado: (1996)

A combined crystallographic, thermal, Raman and computational study on polymorphism and phase transition in 1-(4-hexyloxy-3-hydroxyphenyl)ethanone
por: Suárez, S., et al.

Ammonium, barium hexacyanoferrate(II) trihydrate : Synthesis, crystal structure, thermal decomposition and spectroscopic study
por: Medina Córdoba, Lucrecia, et al.
Publicado: (2015)

A combined crystallographic, thermal, Raman and computational study on polymorphism and phase transition in 1-(4-hexyloxy-3-hydroxyphenyl)ethanone
Publicado: (2017)

The effect of chalcogen substitution on the structure and spectroscopy of 4,7-dimethyl-2<i>H</i>-chromen-2-one/thione analogues
por: Delgado Espinosa, Zuly Yuliana, et al.
Publicado: (2017)

Frontiers of surface-enhanced raman scattering : single-nanoparticles and single cells /
Publicado: (2014)

Crystal structure, Hirshfeld surface analysis, spectroscopic and biological studies on sulfamethazine and sulfaquinoxaline ternary complexes with 2,2′-biquinoline
por: Villa Pérez, Cristian, et al.
Publicado: (2017)

Investigation of stable solid diazonium salt by molecular structure, Hirshfeld surface analysis, optical and electrochemical studies, and applications
por: Shabir, Ghulam, et al.
Publicado: (2021)

Spectroscopic investigations of iron(II) and iron(III) oxalates
por: D'Antonio, Maria C., et al.
Publicado: (2009)

Interaction of Cu(1 1 1) surface states with different extended defects
por: Barral, María Andrea, et al.
Publicado: (1998)

Interaction of Cu(1 1 1) surface states with different extended defects
por: Barral, A., et al.

Specific intermolecular interactions of conserved water molecules with amino acids in the Galectin-1 carbohydrate recognition domain
por: Petruk, Ariel Alcides
Publicado: (2010)

Specific intermolecular interactions of conserved water molecules with amino acids in the Galectin-1 carbohydrate recognition domain
por: Di Lella, S., et al.

A detailed experimental and theoretical study of two novel substituted trifluoromethylchromones : The influence of the bulky bromine atom on the crystal packing
por: Alcívar León, Christian David, et al.
Publicado: (2015)

Synthesis, structural and spectroscopic characterization of thallium(I) acesulfamate
por: Baran, Enrique José, et al.
Publicado: (2015)

Synthesis, conformation and Hirshfeld surface analysis of benzoxazole methyl ester as a versatile building block for heterocycles
por: Saeed, Aamer, et al.
Publicado: (2021)

A complex containing three different kinds of Ru-N bonds: Ethoxydinitro-nitrosyl(N, N, N′, N′-tetramethylethylenediamine-κ 2N, N′)ruthenium(II)
Publicado: (2002)

A complex containing three different kinds of Ru-N bonds: Ethoxydinitro-nitrosyl(N, N, N′, N′-tetramethylethylenediamine-κ 2N, N′)ruthenium(II)
por: Albores, P., et al.

Structural, Spectroscopic, and Thermal Behaviour of Bis-(thiosaccharinate)- aqua-cadmium(II)
por: Tarulli, Susana H., et al.
Publicado: (2001)