DeBeer S - Search Results

1

Molybdenum L-Edge XAS Spectra of MoFe Nitrogenase.

Bjornsson R, Delgado-Jaime MU, Lima FA, Sippel D, Schlesier J, Weyhermüller T, Einsle O, Neese F, DeBeer S. Bjornsson R, et al. Among authors: debeer s. Z Anorg Allg Chem. 2015 Jan;641(1):65-71. doi: 10.1002/zaac.201400446. Epub 2014 Nov 27. Z Anorg Allg Chem. 2015. PMID: 26213424 Free PMC article.

2

Six-membered electron transfer series [V(dithiolene)(3)](z) (z = 1+, 0, 1-, 2-, 3-, 4-). An X-ray absorption spectroscopic and density functional theoretical study.

Sproules S, Weyhermüller T, Debeer S, Wieghardt K. Sproules S, et al. Among authors: debeer s. Inorg Chem. 2010 Jun 7;49(11):5241-61. doi: 10.1021/ic100344f. Inorg Chem. 2010. PMID: 20438108

3

Probing valence orbital composition with iron Kbeta X-ray emission spectroscopy.

Lee N, Petrenko T, Bergmann U, Neese F, DeBeer S. Lee N, et al. Among authors: debeer s. J Am Chem Soc. 2010 Jul 21;132(28):9715-27. doi: 10.1021/ja101281e. J Am Chem Soc. 2010. PMID: 20578760

4

Molecular and electronic structures of dinuclear iron complexes incorporating strongly electron-donating ligands: implications for the generation of the one- and two-electron oxidized forms.

Strautmann JB, Freiherr von Richthofen CG, Heinze-Brückner G, DeBeer S, Bothe E, Bill E, Weyhermüller T, Stammler A, Bögge H, Glaser T. Strautmann JB, et al. Among authors: debeer s. Inorg Chem. 2011 Jan 3;50(1):155-71. doi: 10.1021/ic101535y. Epub 2010 Nov 29. Inorg Chem. 2011. PMID: 21114259

5

A fully delocalized mixed-valence bis-μ(thiolato) dicopper complex: a structural and functional model of the biological CuA center.

Gennari M, Pécaut J, DeBeer S, Neese F, Collomb MN, Duboc C. Gennari M, et al. Among authors: debeer s. Angew Chem Int Ed Engl. 2011 Jun 14;50(25):5662-6. doi: 10.1002/anie.201100605. Epub 2011 May 9. Angew Chem Int Ed Engl. 2011. PMID: 21557415 No abstract available.

6

Experimental and computational investigation of thiolate alkylation in Ni(II) and Zn(II) complexes: role of the metal on the sulfur nucleophilicity.

Gennari M, Retegan M, DeBeer S, Pécaut J, Neese F, Collomb MN, Duboc C. Gennari M, et al. Among authors: debeer s. Inorg Chem. 2011 Oct 17;50(20):10047-55. doi: 10.1021/ic200899w. Epub 2011 Sep 20. Inorg Chem. 2011. PMID: 21932763

7

Identification of a single light atom within a multinuclear metal cluster using valence-to-core X-ray emission spectroscopy.

Delgado-Jaime MU, Dible BR, Chiang KP, Brennessel WW, Bergmann U, Holland PL, DeBeer S. Delgado-Jaime MU, et al. Among authors: debeer s. Inorg Chem. 2011 Nov 7;50(21):10709-17. doi: 10.1021/ic201173j. Epub 2011 Sep 28. Inorg Chem. 2011. PMID: 21954894 Free PMC article.

8

Prediction of high-valent iron K-edge absorption spectra by time-dependent density functional theory.

Chandrasekaran P, Stieber SC, Collins TJ, Que L Jr, Neese F, DeBeer S. Chandrasekaran P, et al. Among authors: debeer s. Dalton Trans. 2011 Nov 14;40(42):11070-9. doi: 10.1039/c1dt11331c. Epub 2011 Sep 29. Dalton Trans. 2011. PMID: 21956429 Free PMC article.

9

Electronic and molecular structures of the members of the electron transfer series [Cr(tbpy)3]n (n = 3+, 2+, 1+, 0): an X-ray absorption spectroscopic and density functional theoretical study.

Scarborough CC, Sproules S, Weyhermüller T, DeBeer S, Wieghardt K. Scarborough CC, et al. Among authors: debeer s. Inorg Chem. 2011 Dec 19;50(24):12446-62. doi: 10.1021/ic201123x. Epub 2011 Nov 15. Inorg Chem. 2011. PMID: 22085200

10

X-ray emission spectroscopy evidences a central carbon in the nitrogenase iron-molybdenum cofactor.

Lancaster KM, Roemelt M, Ettenhuber P, Hu Y, Ribbe MW, Neese F, Bergmann U, DeBeer S. Lancaster KM, et al. Among authors: debeer s. Science. 2011 Nov 18;334(6058):974-7. doi: 10.1126/science.1206445. Science. 2011. PMID: 22096198 Free PMC article.

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