Crystal structure of fac-tricarbonyl(cyclohexyl isocyanide-κC)(quinoline-2-carboxylato-κ2 N,O)rhenium(I)

Charalampos Triantis; Antonio Shegani; Christos Kiritsis; Catherine Raptopoulou; Vassilis Psycharis; Maria Pelecanou; Ioannis Pirmettis; Minas Papadopoulos

doi:10.1107/S2056989016002206

Crystal structure of fac-tricarbonyl(cyclohexyl isocyanide-κC)(quinoline-2-carboxylato-κ² N,O)rhenium(I)

Charalampos Triantis, Antonio Shegani, Christos Kiritsis, Catherine Raptopoulou, Vassilis Psycharis^*, Maria Pelecanou, Ioannis Pirmettis, Minas Papadopoulos

^*Corresponding author for this work

Imaging Chemistry & Biology

Research output: Contribution to journal › Article › peer-review

3 Citations (Scopus)

Abstract

In the title compound, [Re(C₁₀H₆NO₂)(C₇H₁₁N)(CO)₃], the Re^I atom is coordinated by three carbonyl ligands in a facial arrangement and by the N, O and C atoms from a chelating quinaldate anion and a monodentate isocyanide ligand, respectively. The resultant C₄NO coordination sphere is distorted octahedral. A lengthening of the axial Re-CO bond trans to the isocyanide ligand is indicative of the trans effect. Individual complexes are stacked into rods parallel to [001] through displaced π-π interactions. Weak C-H⋯O hydrogen-bonding interactions between the rods lead to the formation of layers parallel to (010). These layers are stacked along [010] by C-H⋯H-C van der Waals contacts.

Original language	English
Pages (from-to)	358-362
Number of pages	5
Journal	Acta Crystallographica Section E: Crystallographic Communications
Volume	72
DOIs	https://doi.org/10.1107/S2056989016002206
Publication status	Published - 1 Jan 2016

Keywords

crystal structure
Hirshfeld surface analysis
rhenium(I) cyclohexyl isocyanide and quinaldic acid complex
rhenium(I) tricarbonyl complex
structural trans effect

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@article{9b58bfbea9224fa184157f3277d073a5,

title = "Crystal structure of fac-tricarbonyl(cyclohexyl isocyanide-κC)(quinoline-2-carboxylato-κ2 N,O)rhenium(I)",

abstract = "In the title compound, [Re(C10H6NO2)(C7H11N)(CO)3], the ReI atom is coordinated by three carbonyl ligands in a facial arrangement and by the N, O and C atoms from a chelating quinaldate anion and a monodentate isocyanide ligand, respectively. The resultant C4NO coordination sphere is distorted octahedral. A lengthening of the axial Re-CO bond trans to the isocyanide ligand is indicative of the trans effect. Individual complexes are stacked into rods parallel to [001] through displaced π-π interactions. Weak C-H⋯O hydrogen-bonding interactions between the rods lead to the formation of layers parallel to (010). These layers are stacked along [010] by C-H⋯H-C van der Waals contacts.",

keywords = "crystal structure, Hirshfeld surface analysis, rhenium(I) cyclohexyl isocyanide and quinaldic acid complex, rhenium(I) tricarbonyl complex, structural trans effect",

author = "Charalampos Triantis and Antonio Shegani and Christos Kiritsis and Catherine Raptopoulou and Vassilis Psycharis and Maria Pelecanou and Ioannis Pirmettis and Minas Papadopoulos",

year = "2016",

month = jan,

day = "1",

doi = "10.1107/S2056989016002206",

language = "English",

volume = "72",

pages = "358--362",

journal = "Acta Crystallographica Section E: Crystallographic Communications",

issn = "2056-9890",

publisher = "International Union of Crystallography",

}

TY - JOUR

T1 - Crystal structure of fac-tricarbonyl(cyclohexyl isocyanide-κC)(quinoline-2-carboxylato-κ2 N,O)rhenium(I)

AU - Triantis, Charalampos

AU - Shegani, Antonio

AU - Kiritsis, Christos

AU - Raptopoulou, Catherine

AU - Psycharis, Vassilis

AU - Pelecanou, Maria

AU - Pirmettis, Ioannis

AU - Papadopoulos, Minas

PY - 2016/1/1

Y1 - 2016/1/1

N2 - In the title compound, [Re(C10H6NO2)(C7H11N)(CO)3], the ReI atom is coordinated by three carbonyl ligands in a facial arrangement and by the N, O and C atoms from a chelating quinaldate anion and a monodentate isocyanide ligand, respectively. The resultant C4NO coordination sphere is distorted octahedral. A lengthening of the axial Re-CO bond trans to the isocyanide ligand is indicative of the trans effect. Individual complexes are stacked into rods parallel to [001] through displaced π-π interactions. Weak C-H⋯O hydrogen-bonding interactions between the rods lead to the formation of layers parallel to (010). These layers are stacked along [010] by C-H⋯H-C van der Waals contacts.

AB - In the title compound, [Re(C10H6NO2)(C7H11N)(CO)3], the ReI atom is coordinated by three carbonyl ligands in a facial arrangement and by the N, O and C atoms from a chelating quinaldate anion and a monodentate isocyanide ligand, respectively. The resultant C4NO coordination sphere is distorted octahedral. A lengthening of the axial Re-CO bond trans to the isocyanide ligand is indicative of the trans effect. Individual complexes are stacked into rods parallel to [001] through displaced π-π interactions. Weak C-H⋯O hydrogen-bonding interactions between the rods lead to the formation of layers parallel to (010). These layers are stacked along [010] by C-H⋯H-C van der Waals contacts.

KW - crystal structure

KW - Hirshfeld surface analysis

KW - rhenium(I) cyclohexyl isocyanide and quinaldic acid complex

KW - rhenium(I) tricarbonyl complex

KW - structural trans effect

UR - http://www.scopus.com/inward/record.url?scp=84960146074&partnerID=8YFLogxK

U2 - 10.1107/S2056989016002206

DO - 10.1107/S2056989016002206

M3 - Article

AN - SCOPUS:84960146074

SN - 2056-9890

VL - 72

SP - 358

EP - 362

JO - Acta Crystallographica Section E: Crystallographic Communications

JF - Acta Crystallographica Section E: Crystallographic Communications

ER -

Crystal structure of fac-tricarbonyl(cyclohexyl isocyanide-κC)(quinoline-2-carboxylato-κ² N,O)rhenium(I)

Abstract

Keywords

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