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Rethinking polyiodides: the role of electron-deficient multicenter bonds

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On the σ, π and δ hole interactions: a molecular orbital overview

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New J. Chem., 2018, 42, 1413
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Competition between sigma and Pi holes on the same atom

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CrystEngComm, 2025, 27, 921
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Ye Olde supramolecular chemistry, its modern rebranding and overarching trends in chemistry

Matteo Savastano

Dalton Trans., 2024, 53, 1373
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Halogen bonds with carbenes acting as Lewis base units: complexes of imidazol-2-ylidene: theoretical analysis and experimental evidence

Sławomir J. Grabowski

Phys. Chem. Chem. Phys., 2023, 25, 9636
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Hydrogen bond types which do not fit accepted definitions

Sławomir J. Grabowski

Chem. Commun., 2024, 60, 6239
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Intermolecular interactions between σ- and π-holes of bromopentafluorobenzene and pyridine: computational and experimental investigations

Fang-Ling Yang, Xing Yang, Rui-Zhi Wu, Chao-Xian Yan, Fan Yang, Weichun Ye, Liang-Wei Zhang and Pan-Pan Zhou

Phys. Chem. Chem. Phys., 2018, 20, 11386
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Tetrel bonding interaction: an analysis with the block-localized wavefunction (BLW) approach

Changwei Wang, Yama Aman, Xiaoxi Ji and Yirong Mo

Phys. Chem. Chem. Phys., 2019, 21, 11776
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Cooperative effects between π-hole triel and π-hole chalcogen bonds

Jingru Zhang, Wenzuo Li, Jianbo Cheng, Zhenbo Liu and Qingzhong Li

RSC Adv., 2018, 8, 26580
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Hydrogen bonds and other interactions as a response to protect doublet/octet electron structure

Sławomir J. Grabowski

J Mol Model, 2018, 24
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A–X⋯σ Interactions—Halogen Bonds with σ-Electrons as the Lewis Base Centre

Sławomir J. Grabowski

Molecules, 2021, 26, 5175
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Magnesium Bonds: From Divalent Mg Centres to Trigonal and Tetrahedral Coordination

Sławomir J. Grabowski

ChemistrySelect, 2018, 3, 3147
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Strong σ-hole triel-bond between C5H5Tr (Tr B, Al, Ga) and N‐base (N‐base NCH, NH3, NC−): Cooperativity and solvation effects

Xiaoting Wang, Bin Li, Hui Wang, Qi Song, Yuxiang Ni and Hongyan Wang

Chemical Physics Letters, 2022, 791, 139377
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Intermolecular Interactions Involving Heavy Alkenes H2Si═TH2(T = C, Si, Ge, Sn, Pb) with H2O and HCl: Tetrel Bond and Hydrogen Bond

Yishan Chen and Fan Wang

ACS Omega, 2020, 5, 30210
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Halide Complexes of 5,6‐Dicyano‐2,1,3‐Benzoselenadiazole with 1 : 4 Stoichiometry: Cooperativity between Chalcogen and Hydrogen Bonding

Ekaterina A. Radiush, Hui Wang, Elena A. Chulanova, Yana A. Ponomareva, Bin Li, Qiao Yu Wei, Georgy E. Salnikov, Svetlana Yu. Petrakova, Nikolay A. Semenov and Andrey V. Zibarev

ChemPlusChem, 2023, 88
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Molecular Hydrogen as a Proton Donor in HH···F Hydrogen Bonds—BF4−···(H2)n Clusters

Sławomir J. Grabowski

ChemPhysChem, 2025, 26
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Electron-Deficient Multicenter Bonding in Phase Change Materials: A Chance for Reconciliation

Francisco Javier Manjón, Hussien H. Osman, Matteo Savastano and Ángel Vegas

Materials, 2024, 17, 2840
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Microhydration of a Carbonyl Group: How does the Molecular Electrostatic Potential (MESP) Impact the Formation of (H2O)n:(R2C═O)Complexes?

Emilie-Laure Zins

J. Phys. Chem. A, 2020, 124, 1720
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Bifurcated Triel Bonds—Hydrides and Halides of 1,2-Bis(Dichloroboryl)Benzene and 1,8-Bis(Dichloroboryl)Naphthalene

Sławomir Grabowski

Crystals, 2019, 9, 503
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Insight into the Metal-Involving Chalcogen Bond in the PdII/PtII-Based Complexes: Comparison with the Conventional Chalcogen Bond

Lili Zhang, Zixuan Shen, Yanli Zeng, Xiaoyan Li and Xueying Zhang

J. Phys. Chem. A, 2024, 128, 5567
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Maximal occupation by bases of π‐hole bands surrounding linear molecules

Steve Scheiner

J Comput Chem, 2022, 43, 319
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Crystal Structures of Protein-Bound Cyclic Peptides

Alpeshkumar K. Malde, Timothy A. Hill, Abishek Iyer and David P. Fairlie

Chem. Rev., 2019, 119, 9861
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Dissection of the Origin of π-Holes and the Noncovalent Bonds in Which They Engage

Steve Scheiner

J. Phys. Chem. A, 2021, 125, 6514
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Comparison between Tetrel Bonded Complexes Stabilized by σ and π Hole Interactions

Wiktor Zierkiewicz, Mariusz Michalczyk and Steve Scheiner

Molecules, 2018, 23, 1416
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Strong Hydrogen Bonds of Coordinated Ammonia Molecules

Jelena M. Živković, Dušan Ž. Veljković and Snežana D. Zarić

Crystal Growth & Design, 2022, 22, 148
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Coordination Polymers between 3,4-Dicyano-1,2,5-telluradiazole and N,N,N′,N′-Tetramethylethane-1,2-diamine: The Decisive Role of Chalcogen Bonding

Nikolay A. Pushkarevsky, Anton I. Smolentsev, Hui Wang, Valeriya E. Shishova, Elena A. Chulanova, Qiaoyu Wei, Yaser Balmohammadi, Ekaterina A. Radiush, Simon Grabowsky, Jens Beckmann, J. Derek Woollins, Nikolay A. Semenov and Andrey V. Zibarev

Crystal Growth & Design, 2024, 24, 5236
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Synthesis, Structural Characterization, and Theoretical Analysis of Nonconventional Bonding in Dinuclear Zinc(II) Complexes with Tridentate Schiff Bases

Biplab Halder, Puspendu Middya, Rosa M. Gomila, Antonio Frontera and Shouvik Chattopadhyay

ACS Omega, 2024, 9, 41787
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Triel Bonds─Interactions without Borders, Similarly as Hydrogen Bonds

Sławomir J. Grabowski

Crystal Growth & Design, 2025, 25, 4539
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Understanding noncovalent bonds and their controlling forces

Steve Scheiner

The Journal of Chemical Physics, 2020, 153
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Coordination of Be and Mg Centres by HCN Ligands – Be…N and Mg…N Interactions

Sławomir J. Grabowski

ChemPhysChem, 2018, 19, 1830
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Te⋯N secondary-bonding interactions in tellurium crystals: Supramolecular aggregation patterns and a comparison with their lighter congeners

Edward R.T. Tiekink

Coordination Chemistry Reviews, 2022, 457, 214397
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Hydrogen Bond and Other Lewis Acid–Lewis Base Interactions as Preliminary Stages of Chemical Reactions

Sławomir J. Grabowski

Molecules, 2020, 25, 4668
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Crystallographic and Computational Characterization of Methyl Tetrel Bonding in S-Adenosylmethionine-Dependent Methyltransferases

Raymond C. Trievel and Steve Scheiner

Molecules, 2018, 23, 2965
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Molecular Hydrogen as a Lewis Base in Hydrogen Bonds and Other Interactions

Sławomir J. Grabowski

Molecules, 2020, 25, 3294
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Synthesis, characterization and photophysical properties of phthalimide-pyrazole compounds: Effect of the substituent in the pyrazole ring on the crystal structures

David Ezenarro-Salcedo, Daniela Fonseca-López, Paulo Cesar Piquini, Bernardo Almeida Iglesias, Mario A Macías and John J. Hurtado

Journal of Molecular Structure, 2025, 1322, 140613
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Hydrogen Bonds of Coordinated Ethylenediamine and a Water Molecule: Joint Crystallographic and Computational Study of Second Coordination Sphere

Jelena M. Živković, Milan R. Milovanović and Snežana D. Zarić

Crystal Growth & Design, 2022, 22, 5198
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Double Centrosymmetric Si···π Tetrel Bonds as New Synthons─Evidence from Crystal Structures and DFT Calculations

Mohammad Aarabi, Samira Gholami and Sławomir J. Grabowski

J. Phys. Chem. A, 2023, 127, 9995
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Effect of carbon hybridization in C—F bond as an electron donor in triel bonds

Qingqing Yang, Zongqing Chi, Qingzhong Li and Steve Scheiner

The Journal of Chemical Physics, 2020, 153
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Supramolecular aggregation patterns featuring Se⋯N secondary-bonding interactions in mono-nuclear selenium compounds: A comparison with their congeners

Edward R.T. Tiekink

Coordination Chemistry Reviews, 2021, 443, 214031
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Acid‐Base and Anion Binding Properties of Tetrafluorinated 1,3‐Benzodiazole, 1,2,3‐Benzotriazole and 2,1,3‐Benzoselenadiazole

Elisabeth Parman, Märt Lõkov, Robert Järviste, Sofja Tshepelevitsh, Nikolay A. Semenov, Elena A. Chulanova, Georgy E. Salnikov, Darya O. Prima, Yuri G. Slizhov, Ivo Leito and Andrey V. Zibarev

ChemPhysChem, 2021, 22, 2329
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Methyl‐π Interactions. Nature of Bonding and Limits of Strength

Steve Scheiner

Chemistry A European J, 2025, 31
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Experimental and theoretical investigation of 1,3-bis(3-hydroxypyridinium)propane dibromide dihydrate, tetrabromozincate hydrate, and tetrabromocuprate

Anna Komasa, Zofia Dega-Szafran, Maciej Jędraszak, Mateusz Gołdyn and Elżbieta Bartoszak-Adamska

Journal of Molecular Structure, 2024, 1309, 138230
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Weak molecular interactions of 1:1 Nitrile–Lewis base complexes: A theoretical perspective on nature of chemical bonding

Giridhar Baburao and Gopi Ragupathy

Computational and Theoretical Chemistry, 2025, 1244, 115072
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Unravelling the Importance of H bonds, σ–hole and π–hole-Directed Intermolecular Interactions in Nature

Subhajit Pramanik and Deepak Chopra

J Indian Inst Sci, 2020, 100, 43
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Recognition and sensing of Lewis bases by 1,2,5-chalcogenadiazoles

Ekaterina A. Radiush, Hui Wang, Elena A. Chulanova, Darya O. Prima, Natalia S. Radaeva, Yana A. Ponomareva, Nikolay A. Semenov and Andrey V. Zibarev

Mendeleev Communications, 2024, 34, 297
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Intramolecular Hydrogen Bond Energy and Its Decomposition—O–H∙∙∙O Interactions

Sławomir Grabowski

Crystals, 2020, 11, 5
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A−H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors

Sławomir J. Grabowski

ChemPhysChem, 2019, 20, 565
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Noncovalent functionalization of graphene via π-hole···π and σ-hole···π interactions

Yong-Hui Zhang, Yu-Liang Li, Jianming Yang, Pan-Pan Zhou and Kefeng Xie

Struct Chem, 2020, 31, 97
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Ga···C Triel Bonds—Why They Are Not Strong Enough to Change Trigonal Configuration into Tetrahedral One: DFT Calculations on Dimers That Occur in Crystal Structures

Sławomir J. Grabowski

IJMS, 2023, 24, 12212
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Cooperative effects between triel and halogen bonds in complexes of pyridine derivatives: An opposite effect of the nitrogen oxidation on triel and halogen bonds

Ruijng Wang, Bo Xiao, Wenzuo Li and Qingzhong Li

Int J of Quantum Chemistry, 2021, 121
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Classification of So-Called Non-Covalent Interactions Based on VSEPR Model

Sławomir J. Grabowski

Molecules, 2021, 26, 4939
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Which triel bond is stronger? TrHX⋯H2Y versus TrH2X⋯H2Y (Tr = Ga, In; X = F, Cl, Br, I; Y = O, S)

Xiaoting Wang, Yuchun Li, Hui Wang, Yuxiang Ni and Hongyan Wang

Theor Chem Acc, 2021, 140
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Remote Substituents as Potential Control Elements for the Solid-State Structures of Hypervalent Iodine(III) Compounds

Guobi Li, Arnold L. Rheingold and John D. Protasiewicz

Inorg. Chem., 2021, 60, 7865
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Regium Bonds between Silver(I) Pyrazolates Dinuclear Complexes and Lewis Bases (N2, OH2, NCH, SH2, NH3, PH3, CO and CNH)

Ibon Alkorta, Cristina Trujillo, Goar Sánchez-Sanz and José Elguero

Crystals, 2020, 10, 137
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The coordination of beryllium and magnesium centres in half-sandwich and sandwich compounds

Sławomir J. Grabowski

Journal of Organometallic Chemistry, 2021, 948, 121906
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σ‐Hole Interactions of Tetrahedral Group IV–VIII Lewis Acid Centers with Lewis Bases: A Comparative Study

Mahmoud A. A. Ibrahim, Yasmeen A. M. Mohamed, Hassan A. A. Abuelliel, Al‐shimaa S. M. Rady, Mahmoud E. S. Soliman, Muhammad Naeem Ahmed, Lamiaa A. Mohamed and Nayra A. M. Moussa

ChemistrySelect, 2021, 6, 11856
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New Type of Halogen Bond: Multivalent Halogen Interacting with π- and σ-Electrons

Sławomir Grabowski

Molecules, 2017, 22, 2150
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The effects of cation–π and anion–π interactions on halogen bonds in the [N⋯X⋯N]+ complexes: A comprehensive theoretical study

Hafez Razmazma and Ali Ebrahimi

Journal of Molecular Graphics and Modelling, 2018, 84, 134
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Strengthening of Noncovalent Bonds Caused by Internal Deformations

Steve Scheiner

J. Phys. Chem. A, 2024, 128, 2357
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Triel–hydride triel bond between ZX3 (Z = B and Al; X = H and Me) and THMe3 (T = Si, Ge and Sn)

Jingru Zhang, Yuanxin Wei, Wenzuo Li, Jianbo Cheng and Qingzhong Li

Applied Organom Chemis, 2018, 32
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Dual function of the boron center of BH(CO)2/BH(N2)2 in halogen- and triel-bonded complexes with hypervalent halogens

Wenbo Dong, Yanqing Wang, Xin Yang, Jianbo Cheng and Qingzhong Li

Journal of Molecular Graphics and Modelling, 2018, 84, 118
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Halogen Bonds between Diiodotetrafluorobenzenes and Halide Anions: Theoretical Analysis

Sławomir J. Grabowski

Crystal Growth & Design, 2023, 23, 489
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Synthesis and complexation of molecular clips based on diphenylglycoluril and halogenated dibenzocrown ethers with paraquat

Leonid S. Kikot, Catherine Yu. Kulygina, Alexander Yu. Lyapunov, Svitlana V. Shishkina, Yevhenii A. Vaksler, Tatiana Yu. Bogashchenko and Tatiana I. Kirichenko

Tetrahedron Letters, 2020, 61, 151839
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Comparative Strengths of Tetrel, Pnicogen, Chalcogen, and Halogen Bonds and Contributing Factors

Wenbo Dong, Qingzhong Li and Steve Scheiner

Molecules, 2018, 23, 1681
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A Theoretical Study of the Halogen Bond between Heteronuclear Halogen and Benzene

Jun Luo, Hongjing Dai, Chenglu Zeng, Dawang Wu and Maoqi Cao

Molecules, 2022, 27, 8078
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Halogen, Chalcogen, and Pnicogen Bonding Involving Hypervalent Atoms

Steve Scheiner and Jia Lu

Chemistry A European J, 2018, 24, 8167
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Steric Crowding in Tetrel Bonds

Steve Scheiner

J. Phys. Chem. A, 2018, 122, 2550
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Unusual substituent effects in the Tr···Te triel bond

Ruijing Wang, Canlin Luo, Qingzhong Li and Steve Scheiner

Int J of Quantum Chemistry, 2021, 121
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Weak σ‐Hole Triel Bond between C5H5Tr (Tr=B, Al, Ga) and Haloethyne: Substituent and Cooperativity Effects

Qingqing Yang, Bohua Zhou, Qingzhong Li and Steve Scheiner

ChemPhysChem, 2021, 22, 481
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Tetrel Bonds with π-Electrons Acting as Lewis Bases—Theoretical Results and Experimental Evidences

Sławomir Grabowski

Molecules, 2018, 23, 1183
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Structural, Theoretical Analysis, and Molecular Docking of Two Benzamide Isomers. Halogen Bonding and Its Role in the Diverse Ways of Coupling with Protein Residues

Rodolfo Moreno-Fuquen, Esteban García-Torres, Kevin Arango-Daraviña and Javier Ellena

Chem. Pharm. Bull., 2022, 70, 782
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Competitive hydrogen-bonding and halogen-bonding interactions in the dimerization of hypobromous acid (HOBr) molecules

Zhongbo Wang, Beichen Shi, Nengzhi Jin and Zhifei Zhang

Struct Chem, 2019, 30, 1335
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Noncovalent Bonds between Tetrel Atoms

Anna Grabarz, Mariusz Michalczyk, Wiktor Zierkiewicz and Steve Scheiner

ChemPhysChem, 2020, 21, 1934
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The Phosphorus Bond, or the Phosphorus-Centered Pnictogen Bond: The Covalently Bound Phosphorus Atom in Molecular Entities and Crystals as a Pnictogen Bond Donor

Pradeep R. Varadwaj, Arpita Varadwaj, Helder M. Marques and Koichi Yamashita

Molecules, 2022, 27, 1487
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Triel‐Bonded Complexes between TrR3 (Tr=B, Al, Ga; R=H, F, Cl, Br, CH3) and Pyrazine

Mariusz Michalczyk, Wiktor Zierkiewicz and Steve Scheiner

ChemPhysChem, 2018, 19, 3122
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Synthesis and crystallographic study of six quaternary salts of N-halomethylated and non-N-halomethylated ammonium: Importance of C-H‧‧‧X (X=F, I) and I‧‧‧I− halogen interactions in the supramolecular structures

Deysy Andrea Molina Giraldo, Luz Amalia Ríos Vásquez, Rubén A. Toscano, Rogelio Ocampo-Cardona, Jessica Johanna Gomez-Peña and Mario A. Macías

Journal of Molecular Structure, 2023, 1271, 133962
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Hexacoordinated Tetrel‐Bonded Complexes between TF4 (T=Si, Ge, Sn, Pb) and NCH: Competition between σ‐ and π‐Holes

Mariusz Michalczyk, Wiktor Zierkiewicz, Rafał Wysokiński and Steve Scheiner

ChemPhysChem, 2019, 20, 959
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Dual Geometry Schemes in Tetrel Bonds: Complexes between TF4 (T = Si, Ge, Sn) and Pyridine Derivatives

Wiktor Zierkiewicz, Mariusz Michalczyk, Rafał Wysokiński and Steve Scheiner

Molecules, 2019, 24, 376
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The interplay and strength of the π⋯H F, C⋯H F, F⋯H F and F⋯H C hydrogen bonds upon the formation of multimolecular complexes based on C2H2⋯HF and C2H4⋯HF small dimers

Leila Cardoso Carvalho, Mauro Alves Bueno and Boaz Galdino de Oliveira

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2019, 213, 438
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Anatomy of π-hole bonds: Linear systems

Steve Scheiner

The Journal of Chemical Physics, 2021, 155
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The dominant component of strong π-hole interactions: electrostatic attraction versus charge transfer

Aleksander Shkurenko

IUCrJ, 2023, 10, 145
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On the reliability of atoms in molecules, noncovalent index, and natural bond orbital to identify and quantify noncovalent bonds

Steve Scheiner

J Comput Chem, 2022, 43, 1814
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Tetrel bonding on graphene

Yu Zhang, Weizhou Wang and Yi-Bo Wang

Computational and Theoretical Chemistry, 2019, 1147, 8
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The Nature of Triel Bonds, a Case of B and Al Centres Bonded with Electron Rich Sites

Sławomir J. Grabowski

Molecules, 2020, 25, 2703
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Triel bond and coordination of triel centres – Comparison with hydrogen bond interaction

Sławomir J. Grabowski

Coordination Chemistry Reviews, 2020, 407, 213171
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Theoretical studies on how to tune the π‐hole pnicogen bonds by substitution and cooperative effects

Lijuan Zhang and Dazhi Li

Int J of Quantum Chemistry, 2021, 121
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The influence of monomer deformation on triel and tetrel bonds between TrR3/TR4 (Tr = Al, Ga, In; T = Si, Ge, Sn) and N-base (N-base = HCN, NH3, CN−)

Xiaoting Wang, Bin Li, Yuchun Li, Hui Wang, Yuxiang Ni and Hongyan Wang

Computational and Theoretical Chemistry, 2021, 1201, 113268
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Pnicogen and tetrel bonds—tetrahedral Lewis acid centres

Sławomir J. Grabowski

Struct Chem, 2019, 30, 1141
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Quantitative Assessment of Tetrel Bonding Utilizing Vibrational Spectroscopy

Daniel Sethio, Vytor Oliveira and Elfi Kraka

Molecules, 2018, 23, 2763
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Interactions Steering Arrangement of Molecules in Crystals

Sławomir J. Grabowski

Crystals, 2020, 10, 130
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