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Lasagna-like supramolecular polymers derived from the PdII osazone complexes via C(sp2)–H⋯Hal hydrogen bonding. / Repina, Olga V.; Novikov, Alexander S.; Khoroshilova, Olesya V.; Kritchenkov, Andreii S.; Vasin, Alexander A.; Tskhovrebov, Alexander G.

в: Inorganica Chimica Acta, Том 502, 119378, 01.03.2020.

Результаты исследований: Научные публикации в периодических изданияхстатьяРецензирование

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@article{7a65ae706c924174bd4684ec8ca5c781,
title = "Lasagna-like supramolecular polymers derived from the PdII osazone complexes via C(sp2)–H⋯Hal hydrogen bonding",
abstract = "Preparation of the novel Pd-II osazone complex and its self-assembly into lasagna-like arrays in the solid state via rare C(sp(2))-H center dot center dot center dot Hal hydrogen bonding, as well as N-H center dot center dot center dot Ph weak contact is reported. The rare Pd-II osazone complex was characterized using elemental analyses (C, H, N), ESI-MS, IR, H-1 and C-13 NMR techniques and X-ray diffraction analysis. The intermolecular non-covalent interactions C-H center dot center dot center dot Cl and N-H center dot center dot center dot Ph responsible for the formation of 1D supramolecular polymeric chains in the crystal were detected and studied by DFT calculations and topological analysis of the electron density distribution within the framework of Bader's theory (QTAIM method). Estimated strength of these non-covalent interactions is 1.3-1.6 kcal/mol.",
keywords = "Crystal engineering, DFT, Hydrogen bonding, Non-covalent interactions, Osazones, Palladium, QTAIM, Schiff-base complexes, Supramolecular polymers, VAN, VOLUMES, IDENTIFICATION, ENERGIES",
author = "Repina, {Olga V.} and Novikov, {Alexander S.} and Khoroshilova, {Olesya V.} and Kritchenkov, {Andreii S.} and Vasin, {Alexander A.} and Tskhovrebov, {Alexander G.}",
year = "2020",
month = mar,
day = "1",
doi = "10.1016/j.ica.2019.119378",
language = "English",
volume = "502",
journal = "Inorganica Chimica Acta",
issn = "0020-1693",
publisher = "Elsevier",

}

RIS

TY - JOUR

T1 - Lasagna-like supramolecular polymers derived from the PdII osazone complexes via C(sp2)–H⋯Hal hydrogen bonding

AU - Repina, Olga V.

AU - Novikov, Alexander S.

AU - Khoroshilova, Olesya V.

AU - Kritchenkov, Andreii S.

AU - Vasin, Alexander A.

AU - Tskhovrebov, Alexander G.

PY - 2020/3/1

Y1 - 2020/3/1

N2 - Preparation of the novel Pd-II osazone complex and its self-assembly into lasagna-like arrays in the solid state via rare C(sp(2))-H center dot center dot center dot Hal hydrogen bonding, as well as N-H center dot center dot center dot Ph weak contact is reported. The rare Pd-II osazone complex was characterized using elemental analyses (C, H, N), ESI-MS, IR, H-1 and C-13 NMR techniques and X-ray diffraction analysis. The intermolecular non-covalent interactions C-H center dot center dot center dot Cl and N-H center dot center dot center dot Ph responsible for the formation of 1D supramolecular polymeric chains in the crystal were detected and studied by DFT calculations and topological analysis of the electron density distribution within the framework of Bader's theory (QTAIM method). Estimated strength of these non-covalent interactions is 1.3-1.6 kcal/mol.

AB - Preparation of the novel Pd-II osazone complex and its self-assembly into lasagna-like arrays in the solid state via rare C(sp(2))-H center dot center dot center dot Hal hydrogen bonding, as well as N-H center dot center dot center dot Ph weak contact is reported. The rare Pd-II osazone complex was characterized using elemental analyses (C, H, N), ESI-MS, IR, H-1 and C-13 NMR techniques and X-ray diffraction analysis. The intermolecular non-covalent interactions C-H center dot center dot center dot Cl and N-H center dot center dot center dot Ph responsible for the formation of 1D supramolecular polymeric chains in the crystal were detected and studied by DFT calculations and topological analysis of the electron density distribution within the framework of Bader's theory (QTAIM method). Estimated strength of these non-covalent interactions is 1.3-1.6 kcal/mol.

KW - Crystal engineering

KW - DFT

KW - Hydrogen bonding

KW - Non-covalent interactions

KW - Osazones

KW - Palladium

KW - QTAIM

KW - Schiff-base complexes

KW - Supramolecular polymers

KW - VAN

KW - VOLUMES

KW - IDENTIFICATION

KW - ENERGIES

UR - http://www.scopus.com/inward/record.url?scp=85076709475&partnerID=8YFLogxK

U2 - 10.1016/j.ica.2019.119378

DO - 10.1016/j.ica.2019.119378

M3 - Article

AN - SCOPUS:85076709475

VL - 502

JO - Inorganica Chimica Acta

JF - Inorganica Chimica Acta

SN - 0020-1693

M1 - 119378

ER -

ID: 51282971