Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 118, Issue 40, Pages 9529-9539Publisher
AMER CHEMICAL SOC
DOI: 10.1021/jp506256a
Keywords
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Funding
- Scientific Council of the President of the Russian Federation [MK-2286.2013.3]
- Government of Saint Petersburg
- Fundacao para a Ciencia e a Tecnologia (FCT), Portugal [PEst-OE/QUI/UI0100/2013, PTDC/QUI-QUI/119561/2010]
- RFBR [14-03-93959, 13-03-12411]
- RAS Presidium
- Visby Program (Sweden)
- Fundação para a Ciência e a Tecnologia [PTDC/QUI-QUI/119561/2010] Funding Source: FCT
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The cationic (1,3,5-triazapentadiene)Pt-II complexes [1](Cl)(2), [2](Cl)(2), [3](Br)(2), and [4](Cl)(2), were crystallized from ROH-containing systems (R = Me, Et) providing alcohol solvates studied by X-ray diffraction. In the crystal structures of [1-4][(Hal)(2)(ROH)(2)] (R = Me, Et), the Hal(-) ion interacts with two or three cations [1-4](2+) by means of two or three or four contacts thus uniting stacked arrays of complexes into the layers. The solvated MeOH or EtOH molecules occupy vacant space, giving contacts with [1-4](2+), and connects to the Hal(-) ion through a hydrogen bridge via the H(IO)O(IS) H atom forming, by means of the Hal(-)center dot center dot center dot HOR (Hal = Cl, Br) contact, the halide-alcohol cluster. Properties of the Cl-center dot center dot center dot HO(Me) H-bond in [1][(Cl)(2)(MeOH)(2)] were analyzed using theoretical DFT methods.
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