Crystal structure and Hirshfeld surface analysis of tris(2,2′-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate

Ignacio Chi-Duran, Zouaoui Setifi, Fatima Setifi, Christian Jelsch, Bernd Morgenstern, Andres Vega, Felipe Herrera, Dinesh Pratap Singh, Kaspar Hegetschweiler, Rabab Boyaala

Resultado de la investigación: Article

Resumen

The title compound, [Ni(C10 H8 N2)3](C9H5N4 O)2 ·2H2O, crystallizes as a racemic mixture in the monoclinic space group C2/c. In the crystal, the 1,1,3,3-tetracyano-2-ethoxypropenide anions and the water molecules are linked by O - H...N hydrogen bonds, forming chains running along the [010] direction. The bpy ligands of the cation are linked to the chain via C - H...π(cation) interactions involving the CH3group. The intermolecular interactions were investigated by Hirshfeld surface analysis and two-dimensional fingerprint plots.

Idioma originalEnglish
Páginas (desde-hasta)867-871
Número de páginas5
PublicaciónActa Crystallographica Section E: Crystallographic Communications
Volumen75
DOI
EstadoPublished - 1 ene 2019

Huella dactilar

Surface analysis
Nickel
Cations
Crystal structure
Positive ions
nickel
cations
crystal structure
Anions
Hydrogen bonds
Negative ions
plots
Ligands
interactions
hydrogen bonds
anions
Hydrogen
Crystals
ligands
Molecules

ASJC Scopus subject areas

  • Chemistry(all)
  • Materials Science(all)
  • Condensed Matter Physics

Citar esto

Chi-Duran, Ignacio ; Setifi, Zouaoui ; Setifi, Fatima ; Jelsch, Christian ; Morgenstern, Bernd ; Vega, Andres ; Herrera, Felipe ; Pratap Singh, Dinesh ; Hegetschweiler, Kaspar ; Boyaala, Rabab. / Crystal structure and Hirshfeld surface analysis of tris(2,2′-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate. En: Acta Crystallographica Section E: Crystallographic Communications. 2019 ; Vol. 75. pp. 867-871.
@article{9b656b0945b740fd9e991c1ad4ee09b6,
title = "Crystal structure and Hirshfeld surface analysis of tris(2,2′-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate",
abstract = "The title compound, [Ni(C10 H8 N2)3](C9H5N4 O)2 ·2H2O, crystallizes as a racemic mixture in the monoclinic space group C2/c. In the crystal, the 1,1,3,3-tetracyano-2-ethoxypropenide anions and the water molecules are linked by O - H...N hydrogen bonds, forming chains running along the [010] direction. The bpy ligands of the cation are linked to the chain via C - H...π(cation) interactions involving the CH3group. The intermolecular interactions were investigated by Hirshfeld surface analysis and two-dimensional fingerprint plots.",
keywords = "crystal structure, Hirshfeld surface analysis, hydrogen bonding, polynitrile ligand",
author = "Ignacio Chi-Duran and Zouaoui Setifi and Fatima Setifi and Christian Jelsch and Bernd Morgenstern and Andres Vega and Felipe Herrera and {Pratap Singh}, Dinesh and Kaspar Hegetschweiler and Rabab Boyaala",
year = "2019",
month = "1",
day = "1",
doi = "10.1107/S2056989019006959",
language = "English",
volume = "75",
pages = "867--871",
journal = "Acta Crystallographica Section E: Crystallographic Communications",
issn = "2056-9890",
publisher = "International Union of Crystallography",

}

Crystal structure and Hirshfeld surface analysis of tris(2,2′-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate. / Chi-Duran, Ignacio; Setifi, Zouaoui; Setifi, Fatima; Jelsch, Christian; Morgenstern, Bernd; Vega, Andres; Herrera, Felipe; Pratap Singh, Dinesh; Hegetschweiler, Kaspar; Boyaala, Rabab.

En: Acta Crystallographica Section E: Crystallographic Communications, Vol. 75, 01.01.2019, p. 867-871.

Resultado de la investigación: Article

TY - JOUR

T1 - Crystal structure and Hirshfeld surface analysis of tris(2,2′-bipyridine)nickel(II) bis(1,1,3,3-tetracyano-2-ethoxypropenide) dihydrate

AU - Chi-Duran, Ignacio

AU - Setifi, Zouaoui

AU - Setifi, Fatima

AU - Jelsch, Christian

AU - Morgenstern, Bernd

AU - Vega, Andres

AU - Herrera, Felipe

AU - Pratap Singh, Dinesh

AU - Hegetschweiler, Kaspar

AU - Boyaala, Rabab

PY - 2019/1/1

Y1 - 2019/1/1

N2 - The title compound, [Ni(C10 H8 N2)3](C9H5N4 O)2 ·2H2O, crystallizes as a racemic mixture in the monoclinic space group C2/c. In the crystal, the 1,1,3,3-tetracyano-2-ethoxypropenide anions and the water molecules are linked by O - H...N hydrogen bonds, forming chains running along the [010] direction. The bpy ligands of the cation are linked to the chain via C - H...π(cation) interactions involving the CH3group. The intermolecular interactions were investigated by Hirshfeld surface analysis and two-dimensional fingerprint plots.

AB - The title compound, [Ni(C10 H8 N2)3](C9H5N4 O)2 ·2H2O, crystallizes as a racemic mixture in the monoclinic space group C2/c. In the crystal, the 1,1,3,3-tetracyano-2-ethoxypropenide anions and the water molecules are linked by O - H...N hydrogen bonds, forming chains running along the [010] direction. The bpy ligands of the cation are linked to the chain via C - H...π(cation) interactions involving the CH3group. The intermolecular interactions were investigated by Hirshfeld surface analysis and two-dimensional fingerprint plots.

KW - crystal structure

KW - Hirshfeld surface analysis

KW - hydrogen bonding

KW - polynitrile ligand

UR - http://www.scopus.com/inward/record.url?scp=85069867032&partnerID=8YFLogxK

U2 - 10.1107/S2056989019006959

DO - 10.1107/S2056989019006959

M3 - Article

VL - 75

SP - 867

EP - 871

JO - Acta Crystallographica Section E: Crystallographic Communications

JF - Acta Crystallographica Section E: Crystallographic Communications

SN - 2056-9890

ER -