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| König, E., Schnakig, R., Kanellakopulos, B., Klenze, R. (1977) Magnetism down to 0.90 K, zero-field splitting, and the ligand field in chromocene. Chemical Physics Letters, 50. 439-441 doi:10.1016/0009-2614(77)80361-8 |
| Jackson, Timothy A., Krzystek, J., Ozarowski, Andrew, Wijeratne, Gayan B., Wicker, Benjamin F., Mindiola, Daniel J., Telser, Joshua (2014) Addition to Vanadocene de Novo: Spectroscopic and Computational Analysis of Bis(η5-cyclopentadienyl)vanadium(II). Organometallics, 33. 1325 doi:10.1021/om500158v |
| Jackson, Timothy A., Krzystek, J., Ozarowski, Andrew, Wijeratne, Gayan B., Wicker, Benjamin F., Mindiola, Daniel J., Telser, Joshua (2012) Vanadocene de Novo: Spectroscopic and Computational Analysis of Bis(η5-cyclopentadienyl)vanadium(II). Organometallics, 31. 8265-8274 doi:10.1021/om300892y |
| |
| Rajasekharan, M. V., Bucher, R., Deiss, E., Zoller, L., Salzer, A. K., Moser, E., Weber, J., Ammeter, J. H. (1983) ESR study of the electronic structure and dynamic Jahn-Teller effect in nickelocenium cation. Journal Of The American Chemical Society, 105 (26) 7516-7522 doi:10.1021/ja00364a006 |
| Malischewski, M., Adelhardt, M., Sutter, J., Meyer, K., Seppelt, K. (2016) Isolation and structural and electronic characterization of salts of the decamethylferrocene dication. Science, 353 (6300). 678-682 doi:10.1126/science.aaf6362 |
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| Not Yet Imported: - book-chapter : 10.1016/B978-0-08-102688-5.00013-1
If you would like this item imported into the Digital Library, please contact us quoting Book ID 9780081026892 |
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| Jones, David J., Gibson, Vernon C., Green, Simon M., Maddox, Peter J., White, Andrew J. P., Williams, David J. (2005) Discovery and Optimization of New Chromium Catalysts for Ethylene Oligomerization and Polymerization Aided by High-Throughput Screening. Journal Of The American Chemical Society, 127 (31) 11037-11046 doi:10.1021/ja0518171 |
| Xu, Tieqi, Mu, Ying, Gao, Wei, Ni, Jianguo, Ye, Ling, Tao, Yanchun (2007) Highly Active Half-Metallocene Chromium(III) Catalysts for Ethylene Polymerization Activated by Trialkylaluminum. Journal Of The American Chemical Society, 129 (8) 2236-2237 doi:10.1021/ja0671363 |
| Albahily, Khalid, Fomitcheva, Valeria, Shaikh, Yacoob, Sebastiao, Elena, Gorelsky, Serge I., Gambarotta, Sandro, Korobkov, Ilia, Duchateau, Robbert (2011) New Self-Activating Organochromium Catalyst Precursor for Selective Ethylene Trimerization. Organometallics, 30. 4201-4210 doi:10.1021/om200560e |
| Trummer, David, Nobile, Anna Giorgia, Payard, Pierre-Adrien, Ashuiev, Anton, Kakiuchi, Yuya, Klose, Daniel, Jeschke, Gunnar, Copéret, Christophe (2022) Union carbide polymerization catalysts: from uncovering active site structures to designing molecularly-defined analogs. Chemical Science, 13 (37) 11091-11098 doi:10.1039/d2sc04235e |
| Hansen, Helge-Boj, Krzystek, J., Telser, Joshua, Swain, Abinash, Rajaraman, Gopalan, Wadepohl, Hubert, Enders, Markus (2022) Solid-State Conformational Isomerism Lacking a Gas-Phase Energy Barrier: Its Structural, Spectroscopic, and Theoretical Identification in an Organochromium(III) Complex. Organometallics, 41 (12) 1558-1564 doi:10.1021/acs.organomet.2c00182 |
| |
| Pasynskii A. A. (1990) Russ. J. Inorg. Chem. 35, 2257 |
| Not Yet Imported: - journal-article : 10.1039/a905892c
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| Burin, Mikhail E., Smirnova, Marina V., Fukin, Georgy K., Baranov, Eugeny V., Bochkarev, Mikhail N. (2006) Neodymium(II) and Dysprosium(II) Iodides in the Reactions with Metallocenes of d-Transition Metals. European Journal of Inorganic Chemistry, 2006 (2) 351-356 doi:10.1002/ejic.200500543 |
| |
| Krzystek, J., Kohl, Gerald, Hansen, Helge-Boj, Enders, Markus, Telser, Joshua (2019) Combining HFEPR and NMR Spectroscopies to Characterize Organochromium(III) Complexes with Large Zero-Field Splitting. Organometallics, 38. 2179-2188 doi:10.1021/acs.organomet.9b00158 |
| |
| Not Yet Imported: - journal-article : 10.1016/S1367-5931(03)00034-6
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| |
| Decker, Andrea, Rohde, Jan-Uwe, Klinker, Eric J., Wong, Shaun D., Que,, Lawrence, Solomon, Edward I. (2007) Spectroscopic and Quantum Chemical Studies on Low-Spin FeIVO Complexes: Fe−O Bonding and Its Contributions to Reactivity. Journal Of The American Chemical Society, 129 (51) 15983-15996 doi:10.1021/ja074900s |
| Srnec, M., Wong, S. D., England, J., Que, L., Solomon, E. I. (2012) -Frontier molecular orbitals in S = 2 ferryl species and elucidation of their contributions to reactivity. Proceedings of the National Academy of Sciences, 109 (36) 14326-14331 doi:10.1073/pnas.1212693109 |
| Srnec, Martin, Wong, Shaun D., Matthews, Megan L., Krebs, Carsten, Bollinger, J. Martin, Solomon, Edward I. (2016) Electronic Structure of the Ferryl Intermediate in the α-Ketoglutarate Dependent Non-Heme Iron Halogenase SyrB2: Contributions to H Atom Abstraction Reactivity. Journal Of The American Chemical Society, 138 (15) 5110-5122 doi:10.1021/jacs.6b01151 |
| Not Yet Imported: - journal-article : 10.1021/acs.jctc.7b00168
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| Not Yet Imported: Journal of Organometallic Chemistry - journal-article : 10.1016/S0022-328X(00)00044-9
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| Gard, Ellen, Haaland, Arne, Novak, David P., Seip, Ragnhild (1975) The molecular structures of dicyclopentadienylvanadium, (C5H5)2V, and dicyclopentadienylchromium, (C5H5)2Cr, determined by gas phase electron diffraction. Journal of Organometallic Chemistry, 88 (2) 181-189 doi:10.1016/s0022-328x(00)91459-1 |
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| There is
a very
early crystal structure by Weiss and Fischer, but it does not provide
atomic coordinates (CSD: CYCPCR). |
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| Not Yet Imported: Journal of Organometallic Chemistry - journal-article : 10.1016/0022-328X(95)05747-D
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| Not Yet Imported: J. Mater. Chem. - journal-article : 10.1039/JM9930300215
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| |
| Kaul, Bharat B., Sommer, Roger D., Noll, Bruce C., Yee, Gordon T. (2000) Synthesis, Structure, and Magnetic Properties of the Charge-Transfer Salt Ferromagnet Decamethylchromocenium Dimethyl Dicyanofumarate,TCurie= 5.7 K. Inorganic Chemistry, 39 (4) 865-868 doi:10.1021/ic991196a |
| |
| Konarev, Dmitri V., Khasanov, Salavat S., Saito, Gunzi, Otsuka, Akihiro, Yoshida, Yukihiro, Lyubovskaya, Rimma N. (2003) Formation of Single-Bonded (C60-)2and (C70-)2Dimers in Crystalline Ionic Complexes of Fullerenes. Journal Of The American Chemical Society, 125 (33) 10074-10083 doi:10.1021/ja035546a |
| Wang, Guangbin, Slebodnick, Carla, Butcher, Ray J., Tam, Mary C., Crawford, T. Daniel, Yee, Gordon T. (2004) A Family of Decamethylmetallocene Charge-Transfer Salt Magnets Using Methyl Tricyanoethylenecarboxylate (MTCE) as the Electron Acceptor. Journal Of The American Chemical Society, 126 (51) 16890-16895 doi:10.1021/ja0457213 |
| Semenov, Nikolay A., Pushkarevsky, Nikolay A., Lonchakov, Anton V., Bogomyakov, Artem S., Pritchina, Elena A., Suturina, Elizaveta A., Gritsan, Nina P., Konchenko, Sergey N., Mews, Ruediger, Ovcharenko, Victor I., Zibarev, Andrey V. (2010) Heterospin π-Heterocyclic Radical-Anion Salt: Synthesis, Structure, and Magnetic Properties of Decamethylchromocenium [1,2,5]Thiadiazolo[3,4-c][1,2,5]thiadiazolidyl. Inorganic Chemistry, 49 (16) 7558-7564 doi:10.1021/ic101064c |
| Not Yet Imported: - journal-article : 10.1039/C1NJ20858F
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| Fortman, George C., Kégl, Tamás, Li, Qian-Shu, Zhang, Xiuhui, Schaefer, Henry F., Xie, Yaoming, King, R. Bruce, Telser, Joshua, Hoff, Carl D. (2007) Spectroscopic Detection and Theoretical Confirmation of the Role of Cr2(CO)5(C5R5)2and ·Cr(CO)2(ketene)(C5R5) as Intermediates in Carbonylation of NNCHSiMe3to OCCHSiMe3by ·Cr(CO)3(C5R5) (R = H, CH3) Journal Of The American Chemical Society, 129 (46) 14388-14400 doi:10.1021/ja075008o |
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| Not Yet Imported: - journal-article : 10.1016/0022-2364(78)90103-8
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| Not Yet Imported: - journal-article : 10.1016/j.jmr.2005.09.007
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| Telser J. (2013) Electron Paramagnetic Resonance 23, 209 |
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| Above
28 500 cm
–1
the MCD signal no longer showed field-
or temperature-dependent
behavior consistent with MCD
C
-terms. This lack of
C
-term signal at high energy is likely due to low light
transmission through the mull sample at these high frequencies. |
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| Aleksanyan, V.T., Lokshin, B.V., Borisov, G.K., Devyatykh, G.G., Smirnov, A.S., Nazarova, R.V., Koningstein, J.A., Gächter, B.F. (1977) Raman spectra of cyclopentadienyl complexes (ith5-C5H5)2M (M = Mn, Cr, V, Ru, Os) Journal of Organometallic Chemistry, 124 (3) 293-298 doi:10.1016/s0022-328x(00)92593-2 |
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| Not Yet Imported: - journal-article : 10.1039/dt9720002507
If you would like this item imported into the Digital Library, please contact us quoting Journal ID |
| Brunold, Thomas C., Tamura, Nobuchika, Kitajima, Nobumasa, Moro-oka, Yoshihiko, Solomon, Edward I. (1998) Spectroscopic Study of [Fe2(O2)(OBz)2{HB(pz‘)3}2]: Nature of the μ-1,2 Peroxide−Fe(III) Bond and Its Possible Relevance to O2Activation by Non-Heme Iron Enzymes. Journal Of The American Chemical Society, 120 (23) 5674-5690 doi:10.1021/ja980129x |
| Jackson, Timothy A., Xie, Juan, Yikilmaz, Emine, Miller, Anne-Frances, Brunold, Thomas C. (2002) Spectroscopic and Computational Studies on Iron and Manganese Superoxide Dismutases: Nature of the Chemical Events Associated with Active-Site pKs. Journal Of The American Chemical Society, 124 (36) 10833-10845 doi:10.1021/ja0266058 |
| We shall refer to the
isolated cation investigated by computational studies as [CrCp
2
]
+
and employ
1
to refer to the experimentally
studied BAr
F
salt. |
| Ballhausen, C. J.
Introduction to Ligand Field Theory
; McGraw-Hill: New York, 1962; pp 99–103. |
| Not Yet Imported: - book-chapter : 10.1007/3-540-07671-9_2
If you would like this item imported into the Digital Library, please contact us quoting Book ID 9783540076711 |
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| Atanasov M. (2012) Molecular Electronic Structures of Transition Metal Complexes II , 149 |
| |
| Not Yet Imported: Structure and Bonding - book-chapter : 10.1007/BFb0118847
If you would like this item imported into the Digital Library, please contact us quoting Book ID 9783540043515 |
| Schönherr T. (2003) In Comprehensive Coordination Chemistry II , 443 |
| Miessler G. L. (2014) Inorganic Chemistry |
| Nagelski, Alexandra L., Ozerov, Mykhaylo, Fataftah, Majed S., Krzystek, J., Greer, Samuel M., Holland, Patrick L., Telser, Joshua (2024) Electronic Structure of Three-Coordinate FeII and CoII β-Diketiminate Complexes. Inorganic Chemistry, 63 (10) 4511-4526 doi:10.1021/acs.inorgchem.3c03388 |
| Reinholdt, Anders, Pividori, Daniel, Laughlin, Alexander L., DiMucci, Ida M., MacMillan, Samantha N., Jafari, Mehrafshan G., Gau, Michael R., Carroll, Patrick J., Krzystek, J., Ozarowski, Andrew, Telser, Joshua, Lancaster, Kyle M., Meyer, Karsten, Mindiola, Daniel J. (2020) A Mononuclear and High-Spin Tetrahedral TiII Complex. Inorganic Chemistry, 59 (24) 17834-17850 doi:10.1021/acs.inorgchem.0c02586 |
| Schweinfurth, David, Krzystek, J., Atanasov, Mihail, Klein, Johannes, Hohloch, Stephan, Telser, Joshua, Demeshko, Serhiy, Meyer, Franc, Neese, Frank, Sarkar, Biprajit (2017) Tuning Magnetic Anisotropy Through Ligand Substitution in Five-Coordinate Co(II) Complexes. Inorganic Chemistry, 56 (9) 5253-5265 doi:10.1021/acs.inorgchem.7b00371 |
| Zolnhofer, Eva M., Wijeratne, Gayan B., Jackson, Timothy A., Fortier, Skye, Heinemann, Frank W., Meyer, Karsten, Krzystek, J., Ozarowski, Andrew, Mindiola, Daniel J., Telser, Joshua (2020) Electronic Structure and Magnetic Properties of a Titanium(II) Coordination Complex. Inorganic Chemistry, 59 (9) 6187-6201 doi:10.1021/acs.inorgchem.0c00311 |
| |
| Ye, Shengfa, Neese, Frank, Ozarowski, Andrew, Smirnov, Dmitry, Krzystek, J., Telser, Joshua, Liao, Ju-Hsiou, Hung, Chen-Hsiung, Chu, Wei-Chen, Tsai, Yi-Feng, Wang, Rong-Chin, Chen, Kun-Yuan, Hsu, Hua-Fen (2010) Family of V(III)-Tristhiolato Complexes Relevant to Functional Models of Vanadium Nitrogenase: Synthesis and Electronic Structure Investigations by Means of High-Frequency and -Field Electron Paramagnetic Resonance Coupled to Quantum Chemical Computations. Inorganic Chemistry, 49 (3) 977-988 doi:10.1021/ic9017745 |
| |
| Maganas, Dimitrios, Sottini, Silvia, Kyritsis, Panayotis, Groenen, Edgar J. J., Neese, Frank (2011) Theoretical Analysis of the Spin Hamiltonian Parameters in Co(II)S4Complexes, Using Density Functional Theory and Correlated ab initio Methods. Inorganic Chemistry, 50 (18) 8741-8754 doi:10.1021/ic200299y |
| |
| Ganyushin, Dmitry, Gilka, Natalie, Taylor, Peter R., Marian, Christel M., Neese, Frank (2010) The resolution of the identity approximation for calculations of spin-spin contribution to zero-field splitting parameters. The Journal of Chemical Physics, 132 (14). 144111pp. doi:10.1063/1.3367718 |
| |
| |
| |
| Andino, José G., Kilgore, Uriah J., Pink, Maren, Ozarowski, Andrew, Krzystek, J., Telser, Joshua, Baik, Mu-Hyun, Mindiola, Daniel J. (2010) Intermolecular C–H bond activation of benzene and pyridines by a vanadium(iii) alkylidene including a stepwise conversion of benzene to a vanadium-benzyne complex. Chemical Science, 1. 351pp. doi:10.1039/c0sc00201a |
| Tran, Ba L., Krzystek, J., Ozarowski, Andrew, Chen, Chung-Hsing, Pink, Maren, Karty, Jonathan A., Telser, Joshua, Meyer, Karsten, Mindiola, Daniel J. (2013) Formation and Reactivity of the Terminal Vanadium Nitride Functionality. European Journal of Inorganic Chemistry, 2013 (22) 3916-3929 doi:10.1002/ejic.201300178 |
| Bruker-AXS.
SAINT Software User’s Guide, Version 7.34a
; Bruker AXS, Inc: Madison, Wisconsin,
USA, 2005. |
| Sheldrick, G. M.
SHELXTL, Version 6.12
; Bruker AXS, Inc: Madison, WI, 2001. |
| Bruker-AXS (2012) SADABS, Verson 2012/1 |
| |
 | |
| |
| Abragam A. (2012) Electron Paramagnetic Resonance of Transition Ions (Oxford Classic Texts in the Physical Sciences) |
| Not Yet Imported: - journal-article : 10.1006/jmre.1999.1952
If you would like this item imported into the Digital Library, please contact us quoting Journal ID |
| Telser, J.
DDN and other Software
; Max Planck Digital Library: Mülheim a.d. Ruhr, Germany, 2025 10.17617/3.XNQCUE. |
| Bendix J. (2003) Comprehensive Coordination Chemistry II, Vol. 2: Fundamentals: Physical Methods, Theoretical Analysis, and Case Studies 2, 673 |
| Not Yet Imported: - journal-article : 10.1002/wcms.1327
If you would like this item imported into the Digital Library, please contact us quoting Journal ID |
| Neese, F.
ORCA─an Ab Initio, Density Functional and Semiempirical Program Package
; Max Planck Institut für Chemische Energiekonversion: Mülheim an der Ruhr, Germany, 2014. |
| Not Yet Imported: WIREs Computational Molecular Science - journal-article : 10.1002/wcms.81
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| |
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| |
| |
| Chemcraft. graphical
software for visualization of quantum chemistry computations., Version
1.8, build 682. https://www.chemcraftprog.com. |
| |
| |
| Not Yet Imported: - journal-article : 10.1016/j.ccr.2006.05.019
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| |
| |
| Angeli, C., Cimiraglia, R., Evangelisti, S., Leininger, T., Malrieu, J.-P. (2001) Introduction ofn-electron valence states for multireference perturbation theory. The Journal of Chemical Physics, 114 (23). 10252-10264 doi:10.1063/1.1361246 |
| Not Yet Imported: Journal of Chemical Theory and Computation - journal-article : 10.1021/ct400136y
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