Pyrazolyliodonium platinum(II) trichloride features the highest positive electrostatic potential on the iodine atom among uncharged halogen bond donors

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Pyrazolyliodonium platinum(II) trichloride features the highest positive electrostatic potential on the iodine atom among uncharged halogen bond donors. / Novikov, Alexander S.; Bolotin, Dmitrii S.; Il’in, Mikhail V.

в: Inorganica Chimica Acta, Том 573, 122335, 01.12.2024.

Результаты исследований: Научные публикации в периодических изданиях › статья › Рецензирование

BibTeX

@article{0f6bf995956a4010848b9f55606b75c8,

title = "Pyrazolyliodonium platinum(II) trichloride features the highest positive electrostatic potential on the iodine atom among uncharged halogen bond donors",

abstract = "This study presents a new uncharged platinum(II) complex with a pyrazolyliodonium ligand, which features an exceptionally large σ-hole on the iodine atom. Single-crystal X-ray diffraction analysis reveals the structure of the [LPtCl3]·2DMF complex, highlighting two types of intermolecular halogen bonds: a C−I⋯O bond with DMF and C−I⋯Cl bonds with the platinum complex. Quantum chemical calculations confirm the high positive electrostatic potential on the iodine σ-hole, demonstrating its significant halogen bond donor ability.",

keywords = "Halogen bond, Platinum(II) complex, Pyrazolyliodonium ligand",

author = "Novikov, {Alexander S.} and Bolotin, {Dmitrii S.} and Il{\textquoteright}in, {Mikhail V.}",

year = "2024",

month = dec,

day = "1",

doi = "10.1016/j.ica.2024.122335",

language = "English",

volume = "573",

journal = "Inorganica Chimica Acta",

issn = "0020-1693",

publisher = "Elsevier",

}

RIS

TY - JOUR

T1 - Pyrazolyliodonium platinum(II) trichloride features the highest positive electrostatic potential on the iodine atom among uncharged halogen bond donors

AU - Novikov, Alexander S.

AU - Bolotin, Dmitrii S.

AU - Il’in, Mikhail V.

PY - 2024/12/1

Y1 - 2024/12/1

N2 - This study presents a new uncharged platinum(II) complex with a pyrazolyliodonium ligand, which features an exceptionally large σ-hole on the iodine atom. Single-crystal X-ray diffraction analysis reveals the structure of the [LPtCl3]·2DMF complex, highlighting two types of intermolecular halogen bonds: a C−I⋯O bond with DMF and C−I⋯Cl bonds with the platinum complex. Quantum chemical calculations confirm the high positive electrostatic potential on the iodine σ-hole, demonstrating its significant halogen bond donor ability.

AB - This study presents a new uncharged platinum(II) complex with a pyrazolyliodonium ligand, which features an exceptionally large σ-hole on the iodine atom. Single-crystal X-ray diffraction analysis reveals the structure of the [LPtCl3]·2DMF complex, highlighting two types of intermolecular halogen bonds: a C−I⋯O bond with DMF and C−I⋯Cl bonds with the platinum complex. Quantum chemical calculations confirm the high positive electrostatic potential on the iodine σ-hole, demonstrating its significant halogen bond donor ability.

KW - Halogen bond

KW - Platinum(II) complex

KW - Pyrazolyliodonium ligand

UR - https://www.mendeley.com/catalogue/e8d26375-ca2a-398e-b6e9-93d95122a75d/

U2 - 10.1016/j.ica.2024.122335

DO - 10.1016/j.ica.2024.122335

M3 - Article

VL - 573

JO - Inorganica Chimica Acta

JF - Inorganica Chimica Acta

SN - 0020-1693

M1 - 122335

ER -

ID: 124401520