List of works - Monika Srebro

A concerted evolution of supramolecular interactions in a {cation; metal complex; π-acid; solvent} anion-π system

scientific article published in 2020

Acid/base-triggered switching of circularly polarized luminescence and electronic circular dichroism in organic and organometallic helicenes

scientific article published on 21 November 2014

Aggregation-Induced Emission-Based Sensing Platform for Selective Detection of Zn2+ : Experimental and Theoretical Investigations

scientific article published on 04 June 2019

Analysis of Optical Activity in Terms of Bonds and Lone-Pairs: The Exceptionally Large Optical Rotation of Norbornenone

article

Anion-π Architectures of HAT(CN) 6 and 5d Polycyanidometalates: [W(CN) 8 ] 3– , [Re(CN) 7 ] 3– , and [Pt(CN) 6 ] 2–

scientific article published on 10 December 2018

Anion-π recognition between [M(CN)6]3- complexes and HAT(CN)6: structural matching and electronic charge density modification.

scientific article published on 2 March 2017

Applications of the ETS-NOCV method in descriptions of chemical reactions

scientific article published on 29 March 2011

Assembly of helicene-capped N,P,N,P,N-helicands within Cu(I) helicates: impacting chiroptical properties by ligand-ligand charge transfer

scientific article

Bimetallic Gold(I) Complexes with Ethynyl-Helicene and Bis-Phosphole Ligands: Understanding the Role of Aurophilic Interactions in their Chiroptical Properties

scientific article published on 23 March 2016

Binding of anionic Pt(II) complexes in a dedicated organic matrix: towards new binary crystalline composites

scientific article published on 08 December 2020

Binding of polar monomers in the complexes with organometallic ethylene polymerization catalysts — Natural orbitals for chemical valence and energy decomposition analysis

Bis-4-aza[6]helicene: A Bis-helicenic 2,2'-Bipyridine with Chemically Triggered Chiroptical Switching Activity

scientific article published on 18 April 2019

Calculating Natural Optical Activity of Molecules from First Principles

scientific article published on May 2017

Chiroptical properties of carbo[6]helicene derivatives bearing extended π-conjugated cyano substituents

scientific article published in August 2013

Computational Analysis of47/49Ti NMR Shifts and Electric Field Gradient Tensors of Half-Titanocene Complexes: Structure-Bonding-Property Relationships

scientific article published on 26 July 2013

Computational Modeling of Polymerization Catalysts

Conformational Stability and Spin States of Cobalt(II) Acetylacetonate: CASPT2 and DFT Study

scientific article published on 01 May 2009

Conformational changes and chiroptical switching of enantiopure bis-helicenic terpyridine upon Zn(2+) binding

scientific article published on 7 April 2016

Correction to "Bis-4-aza[6]helicene: A Bis-helicenic 2,2'-Bipyridine with Chemically Triggered Chiroptical Switching Activity"

scientific article published on 18 June 2019

Crucial Influence of the Intramolecular Hydrogen Bond on the Coordination Mode of RC(S)NHP(S)(OiPr)2in Homoleptic Complexes with NiII

Delocalization error and "functional tuning" in Kohn-Sham calculations of molecular properties

scientific article published on 26 June 2014

Diastereo- and Enantioselective Synthesis of Organometallic Bis(helicene)s by a Combination of CH Activation and Dynamic Isomerization

scientific article published on 31 October 2013

Dinuclear Rhenium Complexes with a Bridging Helicene-bis-bipyridine Ligand: Synthesis, Structure, and Photophysical and Chiroptical Properties

scientific article published on 01 September 2020

Does a Molecule-Specific Density Functional Give an Accurate Electron Density? The Challenging Case of the CuCl Electric Field Gradient

scientific article published on 14 February 2012

Electronic and chiroptical properties of chiral cycloiridiated complexes bearing helicenic NHC ligands

scientific article published on 29 June 2016

Enantiopure Cycloiridiated Complexes Bearing a Pentahelicenic N-Heterocyclic Carbene and Displaying Long-Lived Circularly Polarized Phosphorescence

scientific article published on 19 May 2017

Enantioselective Recognition of Ammonium Carbamates in a Chiral Metal-Organic Framework.

scientific article

Exciton coupling in diketopyrrolopyrrole-helicene derivatives leads to red and near-infrared circularly polarized luminescence.

scientific article published on 15 November 2017

Exploring a reaction mechanism for acetato ligand replacement in paddlewheel tetrakisacetatodirhodium (II,II) complex by ammonia: computational density functional theory study

scientific article published on 13 January 2011

Exploring the conformational space of cobalt(III)-salen catalyst for CO2 /epoxide copolymerization: Effect of quaternary ammonium salts on preference of alternative isomers

scientific article published on 11 June 2018

Giant Faraday Rotation in Mesogenic Organic Molecules

article

Half-Metallocene Titanium(IV) Phenyl Phenoxide for High Temperature Olefin Polymerization: Ortho-Substituent Effect at Ancillaryo-Phenoxy Ligand for Enhanced Catalytic Performance

scholarly article by Tae-Jin Kim et al published 22 September 2009 in Macromolecules

Helicene-grafted vinyl- and carbene-osmium complexes: an example of acid-base chiroptical switching

scientific article

Helicenes Grafted with 1,1,4,4-Tetracyanobutadiene Moieties: π-Helical Push-Pull Systems with Strong Electronic Circular Dichroism and Two-Photon Absorption

scientific article published on 03 September 2018

Influence of CH2Cl2for the structure stabilization of the NiIIcomplex [Ni{6-MeO(O)CC6H4NHC(S)NP(S)(OiPr)2-1,5-S,S′}2]·CH2Cl2

Influence of carbon chain length on physical properties of 3FmHPhF homologues

scientific article published on 21 May 2019

Influence of fluorosubstitution on physical properties of the smectogenic chiral ester

scientific article published in June 2022

Intramolecular hydrogen bonding controls 1,3-N,S- vs. 1,5-S,S′-coordination in NiII complexes of N-thiophosphorylated thioureas RNHC(S)NHP(S)(OiPr)2

scientific article published on 18 February 2011

Ion pairing as a possible clue for discriminating between sodium and potassium in biological and other complex environments

scientific article published on 5 December 2007

Iron Alkynyl Helicenes: Redox-Triggered Chiroptical Tuning in the IR and Near-IR Spectral Regions and Suitable for Telecommunications Applications

scientific article published on 19 May 2016

Large-Scale Synthesis of Helicene-Like Molecules for the Design of Enantiopure Thin Films with Strong Chiroptical Activity.

scientific article published on 21 January 2016

Long-Lived Circularly Polarized Phosphorescence in Helicene-NHC Rhenium(I) Complexes: The Influence of Helicene, Halogen, and Stereochemistry on Emission Properties

scientific article published on 13 March 2020

Modulation of Chiroptical Properties in a Series of Helicene-like Compounds

scientific article published on 22 August 2019

Modulation of circularly polarized luminescence through excited-state symmetry breaking and interbranched exciton coupling in helical push-pull organic systems

scientific article published on 20 November 2019

Molecular Deformation, Charge Flow, and Spongelike Behavior in Anion-π {[M(CN)4 ]2- ;[HAT(CN)6 ]}∞ (M=Ni, Pd, Pt) Supramolecular Stacks

scientific article published on 11 September 2018

On Conformational Flexibility of Half-Titanocene Catalysts with Aryloxy Ligands for High-Temperature Olefin Polymerization Processes: Static and Dynamic Theoretical Studies†

On preference of insertion mechanism in the ethylene polymerization catalyzed by half-titanocene complexes with aryloxy ligands: Static and dynamic theoretical studies

On the Border between Low-Nuclearity and One-Dimensional Solids: A Unique Interplay of 1,2,4-Triazolyl-Based {CuII5(OH)2} Clusters and MoVI-Oxide Matrix

scientific article published on 09 May 2018

On the nature of Ni⋯Ni interaction in a model dimeric Ni complex

article

Optical rotation calculated with time-dependent density functional theory: the OR45 benchmark

scientific article published on 21 September 2011

Palladium Acetate Revisited: Unusual Ring-Current Effects, One-Electron Reduction, and Metal-Metal Bonding

scientific article published on 03 July 2018

Phosphahelicenes: From Chiroptical and Photophysical Properties to OLED Applications

scientific article published on 12 March 2019

Photophysical properties of 1-pyridine-3-phenylpyrazoloquinoline and molecular logic gate implementation

scientific article published in July 2019

QTAIM and ETS-NOCV analyses of intramolecular CH···HC interactions in metal complexes

scientific article published in August 2011

Redox-Active Chiroptical Switching in Mono- and Bis-Iron Ethynylcarbo[6]helicenes Studied by Electronic and Vibrational Circular Dichroism and Resonance Raman Optical Activity

Redox-triggered chiroptical switching activity of ruthenium(III)-bis-(β-diketonato) complexes bearing a bipyridine-helicene ligand.

scientific article published on 2 March 2018

Role of Ancillary Ligands in a Description of Copper(I)−Bis(trimethylsilyl)acetylene bonding. A Theoretical Study

scholarly article by Monika Srebro & Mariusz Mitoraj published 13 July 2009 in Organometallics

Ruthenium-Grafted Vinylhelicenes: Chiroptical Properties and Redox Switching

scientific article published on 6 October 2015

Ruthenium-Vinylhelicenes: Remote Metal-Based Enhancement and Redox Switching of the Chiroptical Properties of a Helicene Core

scientific article published on 25 June 2012

Solvent-induced 1,3-N,S- vs. 1,5-S,S′-coordination in the NiII complex [Ni{p-Me2NC6H4NHC(S)NP(S)(OiPr)2}2]

Spin ground state and magnetic properties of cobalt(II): relativistic DFT calculations guided by EPR measurements of bis(2,4-acetylacetonate)cobalt(II)-based complexes

scientific article published on 25 February 2011

Sterically less-hindered half-titanocene(IV) phenoxides: ancillary-ligand effect on mono-, bis-, and tris(2-alkyl-/arylphenoxy) titanium(IV) chloride complexes

scientific article published in May 2010

Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods

scientific article

Substituent Effect on Conformational Preferences in Ground and Excited States of Selected Schiff Bases: An Insight from Theoretical Calculations

scientific article published on 24 December 2019

Synthesis and Chiroptical Properties of Hexa-, Octa-, and Deca-azaborahelicenes: Influence of Helicene Size and of the Number of Boron Atoms

scientific article published on 18 October 2016

Synthesis, Spectroelectrochemical Behavior, and Chiroptical Switching of Tris(β-diketonato) Complexes of Ruthenium(III), Chromium(III), and Cobalt(III).

scientific article

Theoretical Study on Epoxide Ring-opening in CO2/Epoxide Copolymerization Catalyzed by Bifunctional Salen-Type Cobalt(III) Complexes: Influence of Stereoelectronic Factors

scientific article published on 4 March 2021

Theoretical analysis of bonding in N-heterocyclic carbene-rhodium complexes.

scientific article published in June 2009

Triskelion-shaped iridium-helicene NHC complex

scientific article published in 2021

Tuned Range-Separated Time-Dependent Density Functional Theory Applied to Optical Rotation

scientific article published on 23 December 2011

Unravelling the structure of Magnus' pink salt

scientific article

Valence-shell photoelectron circular dichroism of ruthenium( iii )-tris-(acetylacetonato) gas-phase enantiomers

scientific article published in 2021

enantio-Enriched CPL-active helicene-bipyridine-rhenium complexes

scientific article published on March 2015

List of works by Monika Srebro

A concerted evolution of supramolecular interactions in a {cation; metal complex; π-acid; solvent} anion-π system

Acid/base-triggered switching of circularly polarized luminescence and electronic circular dichroism in organic and organometallic helicenes

Aggregation-Induced Emission-Based Sensing Platform for Selective Detection of Zn2+ : Experimental and Theoretical Investigations

Analysis of Optical Activity in Terms of Bonds and Lone-Pairs: The Exceptionally Large Optical Rotation of Norbornenone

Anion-π Architectures of HAT(CN) 6 and 5d Polycyanidometalates: [W(CN) 8 ] 3– , [Re(CN) 7 ] 3– , and [Pt(CN) 6 ] 2–

Anion-π recognition between [M(CN)6]3- complexes and HAT(CN)6: structural matching and electronic charge density modification.

Applications of the ETS-NOCV method in descriptions of chemical reactions

Assembly of helicene-capped N,P,N,P,N-helicands within Cu(I) helicates: impacting chiroptical properties by ligand-ligand charge transfer

Bimetallic Gold(I) Complexes with Ethynyl-Helicene and Bis-Phosphole Ligands: Understanding the Role of Aurophilic Interactions in their Chiroptical Properties

Binding of anionic Pt(II) complexes in a dedicated organic matrix: towards new binary crystalline composites

Binding of polar monomers in the complexes with organometallic ethylene polymerization catalysts — Natural orbitals for chemical valence and energy decomposition analysis

Bis-4-aza[6]helicene: A Bis-helicenic 2,2'-Bipyridine with Chemically Triggered Chiroptical Switching Activity

Calculating Natural Optical Activity of Molecules from First Principles

Chiroptical properties of carbo[6]helicene derivatives bearing extended π-conjugated cyano substituents

Computational Analysis of47/49Ti NMR Shifts and Electric Field Gradient Tensors of Half-Titanocene Complexes: Structure-Bonding-Property Relationships

Computational Modeling of Polymerization Catalysts

Conformational Stability and Spin States of Cobalt(II) Acetylacetonate: CASPT2 and DFT Study

Conformational changes and chiroptical switching of enantiopure bis-helicenic terpyridine upon Zn(2+) binding

Correction to "Bis-4-aza[6]helicene: A Bis-helicenic 2,2'-Bipyridine with Chemically Triggered Chiroptical Switching Activity"

Crucial Influence of the Intramolecular Hydrogen Bond on the Coordination Mode of RC(S)NHP(S)(OiPr)2in Homoleptic Complexes with NiII

Delocalization error and "functional tuning" in Kohn-Sham calculations of molecular properties

Diastereo- and Enantioselective Synthesis of Organometallic Bis(helicene)s by a Combination of CH Activation and Dynamic Isomerization

Dinuclear Rhenium Complexes with a Bridging Helicene-bis-bipyridine Ligand: Synthesis, Structure, and Photophysical and Chiroptical Properties

Does a Molecule-Specific Density Functional Give an Accurate Electron Density? The Challenging Case of the CuCl Electric Field Gradient

Electronic and chiroptical properties of chiral cycloiridiated complexes bearing helicenic NHC ligands

Enantiopure Cycloiridiated Complexes Bearing a Pentahelicenic N-Heterocyclic Carbene and Displaying Long-Lived Circularly Polarized Phosphorescence

Enantioselective Recognition of Ammonium Carbamates in a Chiral Metal-Organic Framework.

Exciton coupling in diketopyrrolopyrrole-helicene derivatives leads to red and near-infrared circularly polarized luminescence.

Exploring a reaction mechanism for acetato ligand replacement in paddlewheel tetrakisacetatodirhodium (II,II) complex by ammonia: computational density functional theory study

Exploring the conformational space of cobalt(III)-salen catalyst for CO2 /epoxide copolymerization: Effect of quaternary ammonium salts on preference of alternative isomers

Giant Faraday Rotation in Mesogenic Organic Molecules

Half-Metallocene Titanium(IV) Phenyl Phenoxide for High Temperature Olefin Polymerization: Ortho-Substituent Effect at Ancillaryo-Phenoxy Ligand for Enhanced Catalytic Performance

Helicene-grafted vinyl- and carbene-osmium complexes: an example of acid-base chiroptical switching

Helicenes Grafted with 1,1,4,4-Tetracyanobutadiene Moieties: π-Helical Push-Pull Systems with Strong Electronic Circular Dichroism and Two-Photon Absorption

Influence of CH2Cl2for the structure stabilization of the NiIIcomplex [Ni{6-MeO(O)CC6H4NHC(S)NP(S)(OiPr)2-1,5-S,S′}2]·CH2Cl2

Influence of carbon chain length on physical properties of 3FmHPhF homologues

Influence of fluorosubstitution on physical properties of the smectogenic chiral ester

Intramolecular hydrogen bonding controls 1,3-N,S- vs. 1,5-S,S′-coordination in NiII complexes of N-thiophosphorylated thioureas RNHC(S)NHP(S)(OiPr)2

Ion pairing as a possible clue for discriminating between sodium and potassium in biological and other complex environments

Iron Alkynyl Helicenes: Redox-Triggered Chiroptical Tuning in the IR and Near-IR Spectral Regions and Suitable for Telecommunications Applications

Large-Scale Synthesis of Helicene-Like Molecules for the Design of Enantiopure Thin Films with Strong Chiroptical Activity.

Long-Lived Circularly Polarized Phosphorescence in Helicene-NHC Rhenium(I) Complexes: The Influence of Helicene, Halogen, and Stereochemistry on Emission Properties

Modulation of Chiroptical Properties in a Series of Helicene-like Compounds

Modulation of circularly polarized luminescence through excited-state symmetry breaking and interbranched exciton coupling in helical push-pull organic systems

Molecular Deformation, Charge Flow, and Spongelike Behavior in Anion-π {[M(CN)4 ]2- ;[HAT(CN)6 ]}∞ (M=Ni, Pd, Pt) Supramolecular Stacks

On Conformational Flexibility of Half-Titanocene Catalysts with Aryloxy Ligands for High-Temperature Olefin Polymerization Processes: Static and Dynamic Theoretical Studies†

On preference of insertion mechanism in the ethylene polymerization catalyzed by half-titanocene complexes with aryloxy ligands: Static and dynamic theoretical studies

On the Border between Low-Nuclearity and One-Dimensional Solids: A Unique Interplay of 1,2,4-Triazolyl-Based {CuII5(OH)2} Clusters and MoVI-Oxide Matrix

On the nature of Ni⋯Ni interaction in a model dimeric Ni complex

Optical rotation calculated with time-dependent density functional theory: the OR45 benchmark

Palladium Acetate Revisited: Unusual Ring-Current Effects, One-Electron Reduction, and Metal-Metal Bonding

Phosphahelicenes: From Chiroptical and Photophysical Properties to OLED Applications

Photophysical properties of 1-pyridine-3-phenylpyrazoloquinoline and molecular logic gate implementation

QTAIM and ETS-NOCV analyses of intramolecular CH···HC interactions in metal complexes

Redox-Active Chiroptical Switching in Mono- and Bis-Iron Ethynylcarbo[6]helicenes Studied by Electronic and Vibrational Circular Dichroism and Resonance Raman Optical Activity

Redox-triggered chiroptical switching activity of ruthenium(III)-bis-(β-diketonato) complexes bearing a bipyridine-helicene ligand.

Role of Ancillary Ligands in a Description of Copper(I)−Bis(trimethylsilyl)acetylene bonding. A Theoretical Study

Ruthenium-Grafted Vinylhelicenes: Chiroptical Properties and Redox Switching

Ruthenium-Vinylhelicenes: Remote Metal-Based Enhancement and Redox Switching of the Chiroptical Properties of a Helicene Core

Solvent-induced 1,3-N,S- vs. 1,5-S,S′-coordination in the NiII complex [Ni{p-Me2NC6H4NHC(S)NP(S)(OiPr)2}2]

Spin ground state and magnetic properties of cobalt(II): relativistic DFT calculations guided by EPR measurements of bis(2,4-acetylacetonate)cobalt(II)-based complexes

Sterically less-hindered half-titanocene(IV) phenoxides: ancillary-ligand effect on mono-, bis-, and tris(2-alkyl-/arylphenoxy) titanium(IV) chloride complexes

Straightforward access to mono- and bis-cycloplatinated helicenes that display circularly polarized phosphorescence using crystallization resolution methods

Substituent Effect on Conformational Preferences in Ground and Excited States of Selected Schiff Bases: An Insight from Theoretical Calculations

Synthesis and Chiroptical Properties of Hexa-, Octa-, and Deca-azaborahelicenes: Influence of Helicene Size and of the Number of Boron Atoms

Synthesis, Spectroelectrochemical Behavior, and Chiroptical Switching of Tris(β-diketonato) Complexes of Ruthenium(III), Chromium(III), and Cobalt(III).

Theoretical Study on Epoxide Ring-opening in CO2/Epoxide Copolymerization Catalyzed by Bifunctional Salen-Type Cobalt(III) Complexes: Influence of Stereoelectronic Factors

Theoretical analysis of bonding in N-heterocyclic carbene-rhodium complexes.

Triskelion-shaped iridium-helicene NHC complex

Tuned Range-Separated Time-Dependent Density Functional Theory Applied to Optical Rotation

Unravelling the structure of Magnus' pink salt

Valence-shell photoelectron circular dichroism of ruthenium( iii )-tris-(acetylacetonato) gas-phase enantiomers

enantio-Enriched CPL-active helicene-bipyridine-rhenium complexes