Prof Stuart Macgregor
Chair in Computational Inorganic Chemistry
Biography
Stuart received his BSc and PhD from the University of Edinburgh, the latter working with Lesley Yellowlees and Alan Welch on metallaborane chemistry. He then won a NATO Western European Fellowship to work with Odile Eisenstein at the Université de Paris-Sud, where he focussed on computational chemistry and first encountered density functional theory. After two years as a post-doc at the Australian National University he returned to Edinburgh in 1997 to a lectureship at Heriot-Watt University where he was promoted to full professor in 2009. He served as Head of the Institute of Chemical Sciences from 2010 to 2015 and was Co-Director of the EPSRC CDT in Critical Resource Catalysis (CRITICAT) from 2014-2022. In January 2024 he took up the position of Chair of Computational Inorganic Chemistry at the University of St. Andrews. Stuart received the RSC’s 2019 Ludwig Mond Award for work on the mechanisms of C–H and C–F activation and the organometallic chemistry of σ-alkane complexes in the solid state. He was elected FRSE in 2020
PhD supervision
- Ted Brumsen
- Theo Hatcher
- Hrithik Manojkumar
- Daniel Storm
Selected publications
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Open access
Cationic and neutral heterometallic Ir-group 12 element polyhydride compounds: synthesis, structure and reactivity
Walsh, A. M., Martín-Fernández, C., Lowe, J. P., Macgregor, S. A., Mahon, M. F. & Whittlesey, M. K., 1 Jan 2026, (E-pub ahead of print) In: Inorganic Chemistry. ASAP, 10 p.Research output: Contribution to journal › Article › peer-review
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Open access
Intermolecular electrophilic germylation using GeCl4 and Al2Cl6
Łosiewicz, J., Bisai, M. K., Bub, Z. A., Macgregor, S. A. & Ingleson, M. J., 25 May 2026, In: Angewandte Chemie International Edition. 65, 22, p. 1-8 8 p., e7070836.Research output: Contribution to journal › Article › peer-review
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Open access
The characterisation and reactivity of a Rh iii η 1 -σ-alkane complex and the role of a structurally responsive phosphine ligand in solid-state molecular organometallic chemistry
Goodall, J. C., Sajjad, M. A., Furfari, S. K., Altus, K. M., Hatcher, T. S. C., Tizzard, G. J., Page, S. J., Warren, M. R., Lynam, J. M., Macgregor, S. A. & Weller, A. S., 24 Apr 2026, (E-pub ahead of print) In: Chemical Science. Advance ArticleResearch output: Contribution to journal › Article › peer-review
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Open access
An operationally unsaturated iridium-pincer complex that C–H activates methane and ethane in the crystalline solid-state
Gyton, M. R., Sajjad, M. A., Storm, D. J., Altus, K. M., Goodall, J. C., Johnson, C. L., Page, S. J., Edwards, A. J., Piltz, R. O., Duckett, S. B., Macgregor, S. A. & Weller, A. S., 12 Mar 2025, In: Journal of the American Chemical Society. 147, 10, p. 8706-8719 14 p.Research output: Contribution to journal › Article › peer-review
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Open access
[B(O2C2(CF3)4)2]− ([FPB]−): repurposing this weakly coordinating anion for solid-state molecular organometallic (SMOM) chemistry
Altus, K. M., Sajjad, M. A., Macgregor, S. A. & Weller, A. S., 26 May 2025, In: Organometallics. 44, 10, p. 1018-1021 4 p.Research output: Contribution to journal › Article › peer-review
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Open access
Catalytic transfer zincation using ammonium cations
Łosiewicz, J., Bisai, M. K., Nichol, G. S., Macgregor, S. A. & Ingleson, M. J., 14 Aug 2025, (E-pub ahead of print) In: Dalton Transactions. 54, 45, p. 16697-16703 7 p.Research output: Contribution to journal › Article › peer-review
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Open access
Ligand non-innocence and an unusual σ-bond metathesis step enables catalytic borylation using 9-borabicyclo-[3.3.1]-nonane
Bisai, M. K., Łosiewicz, J., Nichol, G. S., Dominey, A. P., Thomas, S. P., Macgregor, S. A. & Ingleson, M. J., 7 Jun 2025, In: Chemical Science. 16, 21, p. 9255-9263 9 p.Research output: Contribution to journal › Article › peer-review
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Square planar Ru(iPr2PCH2CH2NH)2 and its role in fast and selective catalytic amine–borane dehydropolymerization to form high molecular weight polyaminoboranes
Cross, M. J., Sajjad, M. A., Macgregor, S. A. & Weller, A. S., 10 Jun 2025, In: Angewandte Chemie. 64, 24, e202500019.Research output: Contribution to journal › Article › peer-review
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Open access
The mechanism of ruthenium-catalyzed directed C─H arylation of arenes: the key role of bis-cyclometalated intermediates
Domingo-Legarda, P., Neale, S. E., Carpentier, A., McMullin, C. L., Findlay, M., Larrosa, I. & Macgregor, S. A., 6 May 2025, (E-pub ahead of print) In: Angewandte Chemie International Edition. Early View, 10 p., e202506707.Research output: Contribution to journal › Article › peer-review
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Open access
ZnH2 as a precursor to catalytically active Ru–ZnH heterometallic complexes
Pecharman, A.-F., Carpentier, A., Lowe, J. P., Macgregor, S. A., Mahon, M. F. & Whittlesey, M. K., 3 Mar 2025, In: Inorganic Chemistry. 64, 8, p. 4043-4051 9 p.Research output: Contribution to journal › Article › peer-review