Synthetic, Structural, and Spectroscopic Characterization of a Novel Family of High-Spin Iron(II) [(β-Diketiminate)(phosphanylphosphido)] Complexes - Publikacja - MOST Wiedzy

Twoje konto

zaloguj

Wyszukiwarka

Synthetic, Structural, and Spectroscopic Characterization of a Novel Family of High-Spin Iron(II) [(β-Diketiminate)(phosphanylphosphido)] Complexes

Abstrakt

This work describes a series of iron(II) phosphanylphosphido complexes. These compounds were obtained by reacting lithiated diphosphanes R2PP(SiMe3)Li (R = t-Bu, i-Pr) with an iron(II) β-diketiminate complex, [LFe(μ2-Cl)2Li(DME)2] (1), where DME = 1,2-dimethoxyethane and L = Dippnacnac (β-diketiminate). While the reaction of 1 with t-Bu2PP(SiMe3)Li yields [LFe(η1-Me3SiPPt- Bu2)] (2), that of 1 with equimolar amounts of i-Pr2PP(SiMe3)Li, in DME, leads to [LFe(η2-i-Pr2PPSiMe3)](3). In contrast, the reaction of 1 with (i-Pr2N)2PP(SiMe3)Li provides not an iron-containing complex but 1-[(diisopropylamino)phosphine]-2,4-bis(diisopropylamino)-3-(trimethylsilyl)tetraphosphetane (4). The structures of 2−4 were determined using diffractometry. Thus, 2 exhibits a three-coordinate iron site and 3 a four-coordinate iron site. The increase in the coordination number is induced by the change from an anticlinal to a synclinal conformation of the phoshpanylphosphido ligands. The electronic structures of 2 and 3 were assessed through a combined field-dependent 57Fe Mössbauer and highfrequency and -field electron paramagnetic resonance spectroscopic investigation in conjunction with analysis of their magnetic susceptibility and magnetization data. These studies revealed two high-spin iron(II) sites with S = 2 ground states that have different properties. While 2 exhibits a zero-field splitting described by a positive D parameter (D = +17.4 cm−1; E/D = 0.11) for 3, this parameter is negative [D = −25(5) cm−1; E/D = 0.15(5)]. Density functional theory (DFT) and time-dependent DFT (TDDFT) calculations provide insights into the origin of these differences and allow us to rationalize the fine and hyperfine structure parameters of 2 and 3. Thus, for 2, the spin−orbit coupling mixes a z2-type ground state with two low-lying {xz/yz} orbital states. These interactions lead to an easy plane of magnetization, which is essentially parallel to the plane defined by the N−Fe−N atoms. For 3, we find a yz-type ground state that is strongly mixed with a low-lying z2-type orbital state. In this case, the spin−orbit interaction leads to a partial unquenching of the orbital momentum along the x axis, that is, to an easy axis of magnetization oriented roughly along the Fe−P bond of the phosphido moiety.

Cytowania

  • 1 2

    CrossRef

  • 0

    Web of Science

  • 1 3

    Scopus

Autorzy (9)

Cytuj jako

Pełna treść

pobierz publikację
pobrano 31 razy
Wersja publikacji
Accepted albo Published Version
Licencja
Copyright (2017 American Chemical Society)

Słowa kluczowe

Informacje szczegółowe

Kategoria:
Publikacja w czasopiśmie
Typ:
artykuł w czasopiśmie wyróżnionym w JCR
Opublikowano w:
INORGANIC CHEMISTRY nr 56, strony 11030 - 11042,
ISSN: 0020-1669
Język:
angielski
Rok wydania:
2017
Opis bibliograficzny:
Grubba R., Kaniewska K., Ponikiewski Ł., Cristóvão B., Ferenc W., Dragulescu-Andrasi A., Krzystek J., Stoian S., Pikies J.: Synthetic, Structural, and Spectroscopic Characterization of a Novel Family of High-Spin Iron(II) [(β-Diketiminate)(phosphanylphosphido)] Complexes// INORGANIC CHEMISTRY. -Vol. 56, iss. 18 (2017), s.11030-11042
DOI:
Cyfrowy identyfikator dokumentu elektronicznego (otwiera się w nowej karcie) 10.1021/acs.inorgchem.7b01374
Bibliografia: test
  1. Holland, P. L. Electronic Structure and Reactivity of Three- Coordinate Iron Complexes. Acc. Chem. Res. 2008, 41, 905−914. otwiera się w nowej karcie
  2. Holland, P. L. Low Coordinate Iron Complexes as Synthetic Models of Nitrogenase. Can. J. Chem. 2005, 83, 296−301. otwiera się w nowej karcie
  3. Eckert, N. A.; Smith, J. M.; Lachicotte, R. L.; Holland, P. L. Low- Coordinate Fe(II) Amido Complexes of β-Diketiminates: Synthesis, Structure and Reactivity. Inorg. Chem. 2004, 43, 3306−3321. otwiera się w nowej karcie
  4. Bourget-Merle, L.; Lappert, M. F.; Severn, J. R. The Chemistry of β-Diketiminatometal Complexes. Chem. Rev. 2002, 102, 3031−3066. otwiera się w nowej karcie
  5. Andres, H.; Bominaar, E. L.; Smith, J. M.; Eckert, N. A.; Holland, P. L.; Munck, E. Planar Three-Coordinate High-Spin Fe(II) Complexes with Large Orbital Angular Momentum: Mossbauer, Electron Paramagnetic Resonance, and Electronic Structure Studies. J. Am. Chem. Soc. 2002, 124, 3012−3025. otwiera się w nowej karcie
  6. Freedman, D. E.; Harman, W. H.; Harris, T. D.; Long, G. J.; Chang, C. J.; Long, J. R. Slow Magnetic Relaxation in a High-Spin Iron(II) Complex. J. Am. Chem. Soc. 2010, 132, 1224−1225. otwiera się w nowej karcie
  7. Buhro, W. E.; Chisholm, M. H.; Folting, K.; Huffman, J. C.; Martin, J. D.; Streib, W. E. The Tungsten-Tungsten Triple Bond. 17. Mixed Amido-Phosphido Compounds of Formula M 2 (PR 2 ) 2 (NMe 2 ) 4 . Comparisons of Amido and Phosphido Ligation and Bridged and Unbridged Isomers. J. Am. Chem. Soc. 1992, 114, 557−570. otwiera się w nowej karcie
  8. Goel, S. C.; Chiang, M. Y.; Rauscher, D. J.; Buhro, W. E. Comparing the Properties of Homologous Phosphido and Amido Complexes: Synthesis and Characterization of the Disilylphosphido Complexes {M[P(SiMe 3 ) 2 ] 2 } 2 where M = Zn, Cd, Hg, Sn, Pb and Mn. J. Am. Chem. Soc. 1993, 115, 160−169. otwiera się w nowej karcie
  9. Matchett, M. A.; Chiang, M. Y.; Buhro, W. E. Disilylphosphido Complexes M[P(SiPh 3 ) 2 ] 2 , Where M = Zn, Cd, Hg, and Sn: Effective Steric Equivalency of P(SiPh 3 ) 2 and N(SiMe 3 ) 2 Ligands. Inorg. Chem. 1994, 33, 1109−1114. otwiera się w nowej karcie
  10. Schafer, H. Übergangsmetallphosphidokomplexe. IV. Phosphi- do-und Bistrimethylsilylphosphidokomplexe des Eisens. Z. Anorg. Allg. Chem. 1980, 467, 105−122. otwiera się w nowej karcie
  11. Dobbie, R. C.; Mason, P. R. Reactions of a Terminal Phosphido- Group in an Organo-Iron Complex. Part I. Some Oxygen, Sulphur, and Selenium Derivatives. J. Chem. Soc., Dalton Trans. 1973, 1124− 1128. otwiera się w nowej karcie
  12. Lorenz, J.-P.; Pohl, W.; Noẗh, H.; Schmidt, H. P- Funktionalisierte Diferriophosphonium Salze des Typs [{CpFe- otwiera się w nowej karcie
  13. } 2 PPhR] + X − und [{CpFe(CO) 2 } 2 PClR] + X − . J. Organomet. Chem. 1994, 475, 211−221.
  14. Jones, R. A.; Stuart, A. L.; Atwood, J. L.; Hunter, W. E.; Rogers, R. D. Steric Effects of Phosphido Ligands. Synthesis and Crystal Structure of Di-tert-butylphosphido-Bridged Dinuclear Metal-Metal Bonded Complexes of Fe(II), Co(I, II) and Ni(I). Organometallics 1982, 1, 1721−1723. otwiera się w nowej karcie
  15. Smith, J. M.; Sadique, A. R.; Cundari, T. R.; Rodgers, K. R.; Lukat-Rodgers, G.; Lachicotte, R. J.; Flaschenriem, C. J.; Vela, J.; Holland, P. L. Studies of Low-Coordinate Iron Dinitrogen Complexes. J. Am. Chem. Soc. 2006, 128, 756−769. otwiera się w nowej karcie
  16. Bai, G.; Wei, P.; Das, A. K.; Stephan, D. W. P−H and P−P Bond Activation by Ni(I) and Fe(I) β-Diketiminato-Complexes. Dalton Trans. 2006, 1141−1146. otwiera się w nowej karcie
  17. Yao, S.; Szilvaśi, T.; Lindenmaier, N.; Xiong, Y.; Inoue, S.; Adelhardt, M.; Sutter, J.; Meyer, K.; Driess, M. Reductive Cleavage of P 4 by Iron(I) Centres: Synthesis and Structural Characterization of Fe 2 (P 2 ) 2 Complexes with Two Bridging P 2 2-Ligands. Chem. Commun. 2015, 51, 6153−6156. otwiera się w nowej karcie
  18. Spitzer, F.; Graßl, C.; Balaźs, G.; Zolnhofer, E. M.; Meyer, K.; Scheer, M. Influence of the nacnac Ligand in Iron(I)-Mediated P 4 otwiera się w nowej karcie
  19. Transformations. Angew. Chem., Int. Ed. 2016, 55, 4340−4344.
  20. King, A. K.; Buchard, A.; Mahon, M. F.; Webster, R. L. Facile, Catalytic Dehydrocoupling of Phosphines Using β-Diketiminate Iron(II) Complexes. Chem. -Eur. J. 2015, 21, 15960−15963. (19) Espinal-Viguri, M.; King, A. K.; Lowe, J. P.; Mahon, M. F.; Webster, R. L. Hydrophosphination of Unactivated Alkenes and Alkynes Using Iron(II): Catalysis and Mechanistic Insight. ACS Catal. 2016, 6, 7892−7897. otwiera się w nowej karcie
  21. Olkowska-Oetzel, J.; Pikies, J. Chemistry of the Phosphino- phosphinidene t Bu 2 P-P, a Novel π-electron Ligand. Appl. Organomet. Chem. 2003, 17, 28−35. otwiera się w nowej karcie
  22. Pikies, J.; Baum, E.; Matern, E.; Chojnacki, J.; Grubba, R.; Robaszkiewicz, A. The New Synthetic Entry to Phosphinophosphini- dene Complexes. Synthesis and Structural Characterisation of the First Side-on Bonded and the First Terminally Bonded Phosphinophosphi- nidene Zirconium Complexes: [μ-(1,2:2-η-t Bu 2 PP){Zr(Cl)Cp 2 } 2 ] and [{Zr(PPhMe 2 )Cp 2 }(η 1 −P t Bu 2 )]. otwiera się w nowej karcie
  23. Chem. Commun. 2004, 2478− 2479. otwiera się w nowej karcie
  24. Grubba, R.; Wisńiewska, A.; Baranowska, K.; Matern, E.; Pikies, J. Syntheses and Structures of the First Terminal Phosphanylphos- phido Complex of Hafnium [Cp 2 Hf(Cl){η 1 -(Me 3 Si)P-P(NEt 2 ) 2 }] and the First Zirconocene-Phosphanylphosphinidene Dimer [Cp 2 Zr{μ 2 -P- P(NEt 2 ) 2 } 2 ZrCp 2 ]. otwiera się w nowej karcie
  25. Dalton Trans. 2011, 40, 2017−2024. otwiera się w nowej karcie
  26. Grubba, R.; Wisńiewska, A.; Baranowska, K.; Matern, E.; Pikies, J. General Route for the Synthesis of Terminal Phosphanylphosphido Complexes of Zr(IV) and Hf(IV). Structural Investigations of the First Zirconium Complex with a Phosphanylphosphido Ligand. Polyhedron 2011, 30, 1238−1243. otwiera się w nowej karcie
  27. Grubba, R.; Baranowska, K.; Gudat, D.; Pikies, J. Reactions of Lithiated Diphosphanes R 2 P−P(SiMe 3 )Li (R = t Bu, i Pr, i Pr 2 N, Et 2 N) with [Cp 2 WCl 2 ]. Syntheses and Structures of the First Terminal Phosphanylphosphido Complexes of Tungsten(IV). Organometallics 2011, 30, 6655−6660. otwiera się w nowej karcie
  28. Kruczynśki, T.; Grubba, R.; Baranowska, K.; Pikies, J. Syntheses and Structures of the First Terminal Phosphanylphosphido Complexes of Molybdenum(IV). Polyhedron 2012, 39, 25−30. otwiera się w nowej karcie
  29. Zauliczny, M.; Grubba, R.; Ponikiewski, Ł.; Pikies, J. Phosphanylphosphido and Phosphanylphosphinidene Complexes of Zirconium(IV) Supported by Bidentate N,N ligands. Polyhedron 2017, 123, 353−360. otwiera się w nowej karcie
  30. Ponikiewski, Ł.; Ziołkowska, A.; Pikies, J. Reactions of Lithiated Diphosphanes R 2 P−P(SiMe 3 )Li (R = tBu and iPr) with [ Me NacnacTiCl 2 ·THF] and [ Me NacnacTiCl 3 ]. Formation and Struc- ture of Titanium III and Titanium IV β-Diketiminato Complexes Bearing the Side-on Phosphanylphosphido and Phosphanylphosphinidene Functionalities. Inorg. Chem. 2017, 56, 1094−1103. otwiera się w nowej karcie
  31. Domanśka-Babul, W.; Chojnacki, J.; Matern, E.; Pikies, J. Reactions of R 2 P-P(SiMe 3 )Li with [(R′ 3 P) 2 PtCl 2 ]. otwiera się w nowej karcie
  32. A General and Efficient Entrance to Phosphanylphosphinidene Complexes of Platinum. Syntheses and Structures of [(η 2 -PP i Pr 2 )Pt(p-Tol 3 P) 2 ], [(η 2 -PP t Bu 2 )Pt(p-Tol 3 P) 2 ], [{η 2 -PP(N i Pr 2 )2}Pt(p-Tol 3 P) 2 ] and [{(Et 2 PhP) 2 Pt} 2 P 2 ]. otwiera się w nowej karcie
  33. Dalton Trans. 2009, 146−151. otwiera się w nowej karcie
  34. Grubba, R.; Baranowska, K.; Chojnacki, J.; Pikies, J. Access to Side-On Bonded Tungsten Phosphanylphosphinidene Complexes. Eur. J. Inorg. Chem. 2012, 20, 3263−3265. otwiera się w nowej karcie
  35. Grubba, R.; Ordyszewska, A.; Kaniewska, K.; Ponikiewski, Ł.; Chojnacki, J.; Gudat, D.; Pikies, J. Reactivity of Phosphanylphosphi- nidene Complex of Tungsten(VI) toward Phosphines: A New Method of Synthesis of catena-Polyphosphorus Ligands. Inorg. Chem. 2015, 54, 8380−8387. otwiera się w nowej karcie
  36. Grubba, R.; Ordyszewska, A.; Ponikiewski, Ł.; Gudat, D.; Pikies, J. An Investigation on the Chemistry of R 2 PP Ligand: Reactions of Phosphanylphosphinidene Complex of Tungsten(VI) with Electro- philic Reagents. Dalton Trans. 2016, 45, 2172−2179. otwiera się w nowej karcie
  37. Krautscheid, H.; Matern, E.; Kovacs, I.; Fritz, G.; Pikies, J. Komplexchemie P-reicher Phosphane und Silylphosphane. XIV. Phosphinophosphiniden t Bu 2 P-P als Ligand in den Pt-Komplexen [{ η 2 -t Bu 2 P-P}Pt(PPh 3 ) 2 ] und [{ η 2 -t Bu 2 P-P}Pt(PEtPh 2 ) 2 ]. otwiera się w nowej karcie
  38. Z. Anorg. Allg. Chem. 1997, 623, 1917−1924. otwiera się w nowej karcie
  39. Stoian, S. A.; Smith, J. M.; Holland, P. L.; Munck, E.; Bominaar, E. L. Mossbauer, Electron Paramagnetic Resonance, and Theoretical Study of a High-Spin, Four Coordinate Fe(II) Diketiminate Complex. Inorg. Chem. 2008, 47, 8687−8695. otwiera się w nowej karcie
  40. MacDonnell, F. M.; Ruhlandt-Senge, K.; Ellison, J. J.; Holm, R. H.; Power, P. P. Sterically Encumebred Iron(II) Thiolate Complexes: Synthesis and Structure of Trigonal Planar [Fe(SR) 3 ]-(R = 2,4,6-t- Bu 3 C 6 H 2 ) and Mossbauer Spectra of Two and Three-Coordinate Complexes. Inorg. Chem. 1995, 34, 1815−1822. otwiera się w nowej karcie
  41. Sanakis, Y.; Power, P. P.; Stubna, A.; Munck, E. Mossbauer Study of the Three-Coordinate Planar Fe II [Fe(SR) 3 ] − (R = C 6 H 2 - 2,4,6-t Bu 3 ): Model for the Trigonal Iron Sites of the MoFe 7 S 9 : Homocitrate Cofactor of Nitrogenase. Inorg. Chem. 2002, 41, 2690− 2696. (36) Domanśka-Babul, W.; Baranowska, K.; Grubba, R.; Matern, E.; Pikies, J. Syntheses and Crystal Structures of Lithium Derivatives of Diphosphanes R 2 P-P(SiMe 3 )Li·3L, R = Ph, i Pr and Pr 2 N, L = THF or DME. Polyhedron 2007, 26, 5491−5496.
  42. Grubba, R.; Ponikiewski, Ł.; Tomorowicz, Ł.; Pikies, J. [N,N′- Bis(2,6-diisopropylphenyl)pentane-2,4-diamine(1−)-2κ 2 N,N′]-μ 2 - chlorido-1:2κ 2 Cl:Cl-chlorido-2κCl-bis(1,2-dimethoxyethane-1κ 2 O,O′)- iron(II)lithium. Acta Crystallogr. 2010, E66, m707. otwiera się w nowej karcie
  43. Sheldrick, G. M. A Short History of SHELX. Acta Crystallogr., Sect. A: Found. Crystallogr. 2008, 64, 112−122. otwiera się w nowej karcie
  44. Munick, E.; Groves, J. L.; Tumolillo, T. A.; Debrunner, P. G. Computer simulations of Mossbauer spectra for an effective spin S = 1/2 Hamiltonian. Comput. Phys. Commun. 1973, 5, 225−238. otwiera się w nowej karcie
  45. Hassan, A. K.; Pardi, L. A.; Krzystek, J.; Sienkiewicz, A.; Goy, P.; Rohrer, M.; Brunel, L.-C. Ultrawide Band Multifrequency High-Field EMR Technique: A Methodology for Increasing Spectroscopic Information. J. Magn. Reson. 2000, 142, 300−312. otwiera się w nowej karcie
  46. Bain, G. A.; Berry, J. F. Diamagnetic Corrections and Pascal's Constants. J. Chem. Educ. 2008, 85, 532−536. otwiera się w nowej karcie
  47. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Keith, T.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian09, revision D.01; Gaussian, Inc.: Wallingford, CT, 2013.
  48. Glendening, E. D.; Badenhoop, J. K.; Reed, A. E.; Carpenter, J. E.; Bohmann, J. A.; Morales, C. M.; Landis, C. R.; Weinhold, F. NBO6.0; Theoretical Chemistry Institute, University of Wisconsin, Madison, WI, 2013. (45) Vrajmasu, V.; Munck, E.; Bominaar, E. L. Density Functional Study of the Electric Hyperfine Interactions and the Redox-Structural Correlations in the Cofactor of Nitrogenase. Analysis of General Trends in 57 Fe Isomer Shifts. Inorg. Chem. 2003, 42, 5974−5988.
  49. Lu, T.; Chen, F. A Multifunctional Wavefunction Analyzer. J. Comput. Chem. 2012, 33, 580−592. otwiera się w nowej karcie
  50. Weber, L.; Buchwald, S.; Lentz, D.; Preugschat, D.; Stammler, H.-G.; Neumann, B. Transition-Metal-Substituted Diphosphenes. 29. Cycloaddition Reactions of the Diphosphenyl Complex (η 5 -C 5 Me 5 )- (CO) 2 Fe-PP-Mes* (Mes* = 2, 4, 6-tBu 3 C 6 H 2 ) with Hexafluor- oacetone. X-ray Structure Analyses of (η 5 -C 5 Me 5 )(CO)Fe-P( PMes*)OC(CF 3 ) 2 C(O) and (η 5 -C 5 Me 5 )(CO) 2 Fe-P-P(Mes*)OC- (CF 3 ) 2 . Organometallics 1992, 11, 2351−2353. otwiera się w nowej karcie
  51. Wisńiewska, A.; Baranowska, K.; Grubba, R.; Matern, E.; Pikies, J. Reactions of Lithium Salts of Triphosphanes t Bu 2 P-PLi-P t Bu 2 and t Bu 2 P-PLi-P(NEt 2 ) 2 with Metal Complexes [(R 3 P) 2 otwiera się w nowej karcie
  52. MCl 2 ] (M = Ni, Pd, Pt, R 3 P = Et 3 P, pTol 3 P, Ph 2 EtP, i Pr 3 P). Z. Anorg. Allg. Chem. 2010, 636, 1549−1556.
  53. Grubba, R.; Wisńiewska, A.; Ponikiewski, Ł.; Caporali, M.; Peruzzini, M.; Pikies, J. Reactivity of Diimido Complexes of Molybdenum and Tungsten towards Lithium Derivatives of Diphosphanes and Triphosphanes. Eur. J. Inorg. Chem. 2014, 10, 1811−1817. otwiera się w nowej karcie
  54. Appel, R.; Gudat, D.; Niecke, E.; Nieger, M.; Porz, C.; Westermann, H. Synthese und Struktur aminosubstituierter Tetra- phosphetane. Z. Naturforsch., B: J. Chem. Sci. 1991, 46, 865−883. (51) (a) Guẗlich, P.; Bill, E.; Trautwein, A. X. Mossbauer Spectroscopy and Transition Metal Chemistry: Fundamentals and Applications; otwiera się w nowej karcie
  55. Springer-Verlag: Berlin, 2011. (b) Greenwood, N. N.; Gibb, T. C. Mossbauer Spectroscopy; Chapman and Hall: London, 1971. (52) von Schnering, H. G.; Honle, W. Chemistry and Structural Chemistry of Phosphides and Polyphosphides. 48. Bridging Chasms with Polyphosphides. Chem. Rev. 1988, 88, 243−273.
  56. Dragulescu-Andrasi, A.; Miller, L. Z.; Chen, B.; McQuade, D. T.; Shatruk, M. Facile Conversion of Red Phosphorous into Soluble Polyphosphide Anions by Reaction with Potassium Ethoxide. Angew. Chem., Int. Ed. 2016, 55, 3904−3908. (54) (a) Glendening, E. D.; Weinhold, F. Natural Resonance Theory: I. General Formalism. J. Comput. Chem. 1998, 19, 593−609. otwiera się w nowej karcie
  57. Glendening, E. D.; Weinhold, F. Natural Resonance Theory: II. Natural Bond Order and Valency. J. Comput. Chem. 1998, 19, 610− 627. (c) Glendening, E. D.; Badenhoop, J. K.; Weinhold, F. Natural Resonance Theory: III. Chemical Applications. J. Comput. Chem. 1998, 19, 628−646. otwiera się w nowej karcie
  58. Wiberg, K. B.; Stratmann, R. E.; Frisch, M. J. A Time- Dependent Density Functional Theory Study of the Electronically Excited States of Formaldehyde, Acetaldehyde and Acetone. Chem. Phys. Lett. 1998, 297, 60−64. otwiera się w nowej karcie
  59. Stoian, S. A.; Vela, J.; Smith, J. M.; Sadique, A. R.; Holland, P. L.; Munck, E.; Bominaar, E. L. Mossbauer and Computational Study of an N 2 − Bridged Diiron Diketiminate Complex: Parallel Alignement of Iron Spins by Direct Antiferromagnetic Exchange with Activated Dinitrogen. J. Am. Chem. Soc. 2006, 128, 10181−10192 (Table 2 on p 10189). otwiera się w nowej karcie
  60. Pascualini, M. E.; Di Russo, N. V.; Thuijs, A. E.; Ozarowski, A.; Stoian, S. A.; Abboud, K. A.; Christou, G.; Veige, A. S. A High-Spin Square-Planar Fe(II) Complex Stabilized by a Trianionic Pincer-Type Ligand and Conclusive Evidence for Retention of Geometry and Spin State in Solution. Chem. Sci. 2015, 6, 608−612. otwiera się w nowej karcie
  61. Gismelseed, A.; Bominaar, E. L.; Bill, E.; Trautwein, A. X.; Winkler, H.; Nasri, H.; Doppelt, P.; Mandon, J.; Fischer, J.; Weiss, F. R. Six-Coordinate Quantum-Mechanically Weakly Spin-Mixed (S = 5/ 2, 3/2) (triflato)aquairon(III) "Picket-Fence" Porphyrin Complex: Synthesis and Structural, Mossbauer, EPR, and Magnetic Character- ization. Inorg. Chem. 1990, 29, 2741−2749. otwiera się w nowej karcie
  62. Fitzsimmons, B. W.; Johnson, C. E. The Mossbauer Spectrum of a Three-Coordinate Compound, tris (hexamethyldisilylaminato) iron(III), Fe[N(SiMe 3 ) 2 ] 3 . Chem. Phys. Lett. 1974, 24, 422−424. otwiera się w nowej karcie
Weryfikacja:
Politechnika Gdańska

wyświetlono 131 razy

Publikacje, które mogą cię zainteresować

Reactions of (Ph)tBuP-P(SiMe3)Li·3THF with [(PNP)TiCl2] and [MeNacNacTiCl2·THF]. Synthesis of first PNP titanium(IV) complex with phosphanylphosphinidene ligand [(PNP)Ti(Cl){η2-P-P(Ph)tBu}]

2018

Homoleptic mono-, di-, and tetra-iron complexes featuring phosphido ligands: a synthetic, structural, and spectroscopic study

2020

Study of Integer Spin S = 1 in the Polar Magnet β-Ni(IO3)2

2021

Probing the Magnetic Anisotropy of Co(II) Complexes Featuring Redox-Active Ligands

2020
Meta Tagi