Metalating 5-Methyl-2-[(2-nitrophenyl)amino]-3-thiophenecarbonitrile (ROY): Understanding the Denticity and Speciation of Complexes of the ROY Anion

Kumar, Amit; Pandey, Pragati; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J.

doi:10.1021/acs.inorgchem.2c02629

Metalating 5-Methyl-2-[(2-nitrophenyl)amino]-3-thiophenecarbonitrile (ROY): Understanding the Denticity and Speciation of Complexes of the ROY Anion

Journal Article · Wed Dec 14 23:00:00 EST 2022 · Inorganic Chemistry

DOI:https://doi.org/10.1021/acs.inorgchem.2c02629· OSTI ID:2420600

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P. Roy and Diana T. Vagelos Laboratories, Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, Pennsylvania 19104, United States; OSTI
P. Roy and Diana T. Vagelos Laboratories, Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, Pennsylvania 19104, United States

Not provided.

Research Organization:: Univ. of Pennsylvania, Philadelphia, PA (United States)

Sponsoring Organization:: USDOE Office of Science (SC)

DOE Contract Number:: SC0017259

OSTI ID:: 2420600

Journal Information:: Inorganic Chemistry, Journal Name: Inorganic Chemistry Journal Issue: 51 Vol. 61; ISSN 0020-1669

Publisher:: American Chemical Society (ACS)

Country of Publication:: United States

Language:: English

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Incorporation of [CpRh] and [CpIr] Species into Heterobimetallic Complexes via Protonolysis Reactivity and Dioximato Chelation Kumar, Amit; Comadoll, Chelsea G.; King, Daniel S. Inorganic Chemistry, Vol. 60, Issue 18 https://doi.org/10.1021/acs.inorgchem.1c01362	journal	August 2021
New Polymorphs of ROY and New Record for Coexisting Polymorphs of Solved Structures Chen, Shuang; Guzei, Ilia A.; Yu, Lian Journal of the American Chemical Society, Vol. 127, Issue 27 https://doi.org/10.1021/ja052098t	journal	July 2005
How many more polymorphs of ROY remain undiscovered Beran, Gregory J. O.; Sugden, Isaac J.; Greenwell, Chandler Chemical Science, Vol. 13, Issue 5 https://doi.org/10.1039/D1SC06074K	journal	January 2022
Conformational and Color Polymorphism of 5-Methyl-2-[(2-nitrophenyl)amino]-3-thiophenecarbonitrile Stephenson, G. A.; Borchardt, T. B.; Byrn, S. R. Journal of Pharmaceutical Sciences, Vol. 84, Issue 11 https://doi.org/10.1002/jps.2600841122	journal	November 1995
Direct evidence for distinct colour origins in ROY polymorphs Warren, Lisette R.; McGowan, Evana; Renton, Margaret Chemical Science, Vol. 12, Issue 38 https://doi.org/10.1039/D1SC04051K	journal	January 2021
Selective Nucleation and Discovery of Organic Polymorphs through Epitaxy with Single Crystal Substrates Mitchell, Christine A.; Yu, Lian; Ward, Michael D. Journal of the American Chemical Society, Vol. 123, Issue 44 https://doi.org/10.1021/ja004085f	journal	October 2001
A Family of Mixed-Metal Cyanide Cubes with Alternating Octahedral and Tetrahedral Corners Exhibiting a Variety of Magnetic Behaviors Including Single Molecule Magnetism Schelter, Eric J.; Karadas, Ferdi; Avendano, Carolina Journal of the American Chemical Society, Vol. 129, Issue 26 https://doi.org/10.1021/ja0683281	journal	July 2007
ROY revisited, again: the eighth solved structure Tan, Melissa; Shtukenberg, Alexander G.; Zhu, Shengcai Faraday Discussions, Vol. 211 https://doi.org/10.1039/C8FD00039E	journal	January 2018
Polymorphism in Molecular Solids: An Extraordinary System of Red, Orange, and Yellow Crystals Yu, Lian Accounts of Chemical Research, Vol. 43, Issue 9 https://doi.org/10.1021/ar100040r	journal	September 2010
A Family of Cyanide-Bridged Molecular Squares: Structural and Magnetic Properties of [{M^IICl₂}₂{Co^II(triphos)(CN)₂}₂]·xCH₂Cl₂, M = Mn, Fe, Co, Ni, Zn Karadas, Ferdi; Schelter, Eric J.; Shatruk, Michael Inorganic Chemistry, Vol. 47, Issue 6 https://doi.org/10.1021/ic702084e	journal	February 2008
Accuracy and reproducibility in crystal structure prediction: the curious case of ROY Nyman, Jonas; Yu, Lian; Reutzel-Edens, Susan M. CrystEngComm, Vol. 21, Issue 13 https://doi.org/10.1039/C8CE01902A	journal	January 2019
Color Changes Caused by Conformational Polymorphism: Optical-Crystallography, Single-Crystal Spectroscopy, and Computational Chemistry Yu, Lian The Journal of Physical Chemistry A, Vol. 106, Issue 3 https://doi.org/10.1021/jp013019c	journal	December 2001
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Encapsulated Nanodroplet Crystallization of Organic-Soluble Small Molecules Tyler, Andrew R.; Ragbirsingh, Ronnie; McMonagle, Charles J. Chem, Vol. 6, Issue 7 https://doi.org/10.1016/j.chempr.2020.04.009	journal	July 2020
ROY Reclaims Its Crown: New Ways To Increase Polymorphic Diversity Lévesque, Alexandre; Maris, Thierry; Wuest, James D. Journal of the American Chemical Society, Vol. 142, Issue 27 https://doi.org/10.1021/jacs.0c04434	journal	June 2020
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