Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms

article Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms published Christian A. Schröder author Sanjib Saha author Klaus Huber author 237 Stefano Leoni author Michael Wiebcke author 314 department Abstract In this report, we summarize our experimental and theoretical investigations in the zinc(II) imidazolate, [Zn(im)2], and zinc(II) 4,5-dichloroimidazolate, [Zn(dcim)2], systems that have been published previously. This comprises a study on the thermodynamic stabilities of the two densest phases with coi and zni framework structures in the [Zn(im)2] system including the discovery and characterization of a new [Zn(im)2·0.5py]-neb phase (py = pyridine), a study on the mechanism of formation of the [Zn(im)2]-zni phase as well as a study on the discovery and characterization of a new [Zn(dcim)2]-SOD phase. In addition, we present as yet unpublished work. This concerns the discovery and characterization of a new [Zn(im)2·0.5mor]-neb phase (mor = morpholine) and investigations of the mechanisms of crystallization of [Zn(im)2·0.5py]-neb and [Zn(im)2·0.5mor]-neb as well as an evalutation of time-resolved SAXS/WAXS data recorded in-situ during the formation of [Zn(im)2]-zni. Walter de Gruyter GmbH2014 eng Inorganic ChemistryCondensed Matter PhysicsGeneral Materials Science Zeitschrift für Kristallographie - Crystalline Materials 2196-7105 2194-494610.1515/zkri-2014-1788 22912807-822 Schröder, C. A., Saha, S., Huber, K., Leoni, S., & Wiebcke, M. (2014). Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms. Zeitschrift Für Kristallographie - Crystalline Materials, 229(12), 807–822. <a href="https://doi.org/10.1515/zkri-2014-1788">https://doi.org/10.1515/zkri-2014-1788</a> @article{Schröder_Saha_Huber_Leoni_Wiebcke_2014, title={Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms}, volume={229}, DOI={<a href="https://doi.org/10.1515/zkri-2014-1788">10.1515/zkri-2014-1788</a>}, number={12}, journal={Zeitschrift für Kristallographie - Crystalline Materials}, publisher={Walter de Gruyter GmbH}, author={Schröder, Christian A. and Saha, Sanjib and Huber, Klaus and Leoni, Stefano and Wiebcke, Michael}, year={2014}, pages={807–822} } Schröder, Christian A., et al. “Metastable Metal Imidazolates: Development of Targeted Syntheses by Combining Experimental and Theoretical Investigations of the Formation Mechanisms.” Zeitschrift Für Kristallographie - Crystalline Materials, vol. 229, no. 12, Walter de Gruyter GmbH, 2014, pp. 807–22, doi:<a href="https://doi.org/10.1515/zkri-2014-1788">10.1515/zkri-2014-1788</a>. C.A. Schröder, S. Saha, K. Huber, S. Leoni, M. Wiebcke, Zeitschrift Für Kristallographie - Crystalline Materials 229 (2014) 807–822. C. A. Schröder, S. Saha, K. Huber, S. Leoni, and M. Wiebcke, “Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms,” Zeitschrift für Kristallographie - Crystalline Materials, vol. 229, no. 12, pp. 807–822, 2014, doi: <a href="https://doi.org/10.1515/zkri-2014-1788">10.1515/zkri-2014-1788</a>. Schröder, Christian A., Sanjib Saha, Klaus Huber, Stefano Leoni, and Michael Wiebcke. “Metastable Metal Imidazolates: Development of Targeted Syntheses by Combining Experimental and Theoretical Investigations of the Formation Mechanisms.” Zeitschrift Für Kristallographie - Crystalline Materials 229, no. 12 (2014): 807–22. <a href="https://doi.org/10.1515/zkri-2014-1788">https://doi.org/10.1515/zkri-2014-1788</a>. Schröder CA, Saha S, Huber K, Leoni S, Wiebcke M. Metastable metal imidazolates: development of targeted syntheses by combining experimental and theoretical investigations of the formation mechanisms. Zeitschrift für Kristallographie - Crystalline Materials. 2014;229(12):807-822. doi:<a href="https://doi.org/10.1515/zkri-2014-1788">10.1515/zkri-2014-1788</a> 418412023-02-06T12:52:06Z2023-02-06T12:52:23Z