Works matching Chemical bond lengths

Results: 1237

Chemical Speciation and Bond Lengths of Organic Solutes by Core-Level Spectroscopy: pH and Solvent Influence on p-Aminobenzoic Acid.

Published in:

Chemistry - A European Journal, 2015, v. 21, n. 19, p. 7256, doi. 10.1002/chem.201405635

By:

Stevens, Joanna S.;
Gainar, Adrian;
Suljoti, Edlira;
Xiao, Jie;
Golnak, Ronny;
Aziz, Emad F.;
Schroeder, Sven L. M.

Publication type:

Article

A Novel Strategy for Comprehensive Estimation of Lattice Energy, Bulk Modulus, Chemical Hardness and Electronic Polarizability of A N B 8-N Binary Inorganic Crystals.

Published in:

Crystals (2073-4352), 2023, v. 13, n. 4, p. 668, doi. 10.3390/cryst13040668

By:

Zhao, Xinyu;
Wang, Xiaoli

Publication type:

Article

A Series of Diamagnetic Pyridine Monoimine Rhenium Complexes with Different Degrees of Metal-to-Ligand Charge Transfer: Correlating 13C NMR Chemical Shifts with Bond Lengths in Redox-Active Ligands.

Published in:

Chemistry - A European Journal, 2016, v. 22, n. 30, p. 10638, doi. 10.1002/chem.201600679

By:

Sieh, Daniel;
Kubiak, Clifford P.

Publication type:

Article

The Second Protonation in the Bio-Catalytic Cycles of the Enzymes Cytochrome P450 and Superoxide Reductase.

Published in:

Reactions (2624-781X), 2024, v. 5, n. 4, p. 778, doi. 10.3390/reactions5040039

By:

Spataru, Tudor;
Dascalu, Lisa Maria;
Moraru, Andreea;
Moraru, Mariana

Publication type:

Article

Theoretical study of the catalytic effect of TM-C4H4 and TM-C5H5 (TM = Cr, Ti, V, Sc) on the activation of O2 at the cathode and CH3OH at the anode in "CH3OH-O2″ fuel cell via DFT computational method.

Published in:

Arabian Journal of Chemistry, 2021, v. 14, n. 4, p. N.PAG, doi. 10.1016/j.arabjc.2021.103062

By:

Nasim Rahnama, Seyedeh;
Aghaie, Mehran;
Noei, Maziar;
Aghaie, Hossein

Publication type:

Article

Molecular theory considering nuclear potential wells.

Published in:

Journal of Molecular Modeling, 2021, v. 27, n. 6, p. 1, doi. 10.1007/s00894-021-04804-2

By:

Zadeh, Dariush Habibollah

Publication type:

Article

Structural and Optical Properties of ZnO:Al Thin Films Produced by Magnetron Sputtering with Different Oxygen Flow: An Experimental and Ab Initio Study.

Published in:

Physica Status Solidi. A: Applications & Materials Science, 2020, v. 217, n. 19, p. 1, doi. 10.1002/pssa.202000167

By:

Queiroz, José César Augusto de;
Filho, João Batista de Azevedo;
Feitor, Michelle Cerqueira;
Libório, Maxwell Santana;
Santos, Edson José da Costa;
Souto, Ulisses Borges;
de Sousa, Rômulo Ribeiro Magalhães;
Costa, Thércio Henrique de Carvalho

Publication type:

Article

Structural Manifestations of the Polarizability Effect in 1-Halogensilatranes According to the Dipole-Induced Dipole Mechanism.

Published in:

Journal of Structural Chemistry, 2019, v. 60, n. 6, p. 932, doi. 10.1134/S0022476619060076

By:

Tandura, S. N.;
Belyaeva, V. V.;
Baryshok, V. P.;
Gostevsky, B. A.;
Smirnov, V. I.

Publication type:

Article

Associations between ALDOB polymorphisms and intrahepatic cholestasis of pregnancy susceptibility in the Chinese Han population.

Published in:

Ginekologia Polska, 2024, v. 95, n. 3, p. 132, doi. 10.5603/gpl.92931

By:

Xianxian Liu;
Siming Xin;
Jiusheng Zheng;
Huai Liu;
Yang Zeng;
Xiaoying Wu;
Feng Zhang;
Xiaoming Zeng;
Yang Zou;
Hua Lai

Publication type:

Article

Associations between ALDOB polymorphisms and intrahepatic cholestasis of pregnancy susceptibility in the Chinese Han population.

Published in:

Ginekologia Polska, 2024, v. 95, n. 2, p. 132, doi. 10.5603/gpl.92931

By:

Xianxian Liu;
Siming Xin;
Jiusheng Zheng;
Huai Liu;
Yang Zeng;
Xiaoying Wu;
Feng Zhang;
Xiaoming Zeng;
Yang Zou;
Hua Lai

Publication type:

Article

The nonlinear optical properties of AlPc-Cl organic compound using DFT and TD-DFT analysis, as well as filter optical-electrical properties.

Published in:

Journal of Nonlinear Optical Physics & Materials, 2023, v. 32, n. 4, p. 1, doi. 10.1142/S0218863523500352

By:

Benhaliliba, M.;
Ahmed, A. Ben;
Ayeshamariam, A.

Publication type:

Article

Statistical Distributions of Physical Characteristics of Molecules with Casimir Force in the Transfer of Admixtures in Nanoscale Volumes.

Published in:

Journal of Applied Mathematics, 2019, p. 1, doi. 10.1155/2019/7915780

By:

Uvarova, Liudmila;
Babarin, Sergey

Publication type:

Article

First-Principles Study on Graphene/Mg 2 Si Interface of Selective Laser Melting Graphene/Aluminum Matrix Composites.

Published in:

Metals (2075-4701), 2021, v. 11, n. 6, p. 941, doi. 10.3390/met11060941

By:

Zhao, Zhanyong;
Chang, Shijie;
Wang, Jie;
Bai, Peikang;
Du, Wenbo;
Zhao, Wenjie

Publication type:

Article

POLYHEDRONS ARE VERY DIFFERENT IN PROPERTIES FROM THE BODIES OF ARCHIMEDES AND THEIR HIGH-DIMENSIONAL ANALOGS.

Published in:

Journal of Nature Science & Sustainable Technology, 2021, v. 15, n. 3, p. 97

By:

Zhizhin, Gennadiy Vladimirovich

Publication type:

Article

Quantum-Chemical Prediction of Molecular and Electronic Structure of Carbon-Nitrogen Chemical Compound with Unusual Ratio Atoms: C(N 20).

Published in:

International Journal of Molecular Sciences, 2023, v. 24, n. 6, p. 5172, doi. 10.3390/ijms24065172

By:

Mikhailov, Oleg V.;
Chachkov, Denis V.

Publication type:

Article

Self‐Expanding Ion‐Transport Channels on Anodes for Fast‐Charging Lithium‐Ion Batteries.

Published in:

Angewandte Chemie, 2022, v. 134, n. 7, p. 1, doi. 10.1002/ange.202113313

By:

An, Juan;
Zhang, Hongyu;
Qi, Lu;
Li, Guoxing;
Li, Yuliang

Publication type:

Article

Effect of Mg(II) and Na(I) Doping on the Electronic Structure and Mechanical Properties of Kaolinite.

Published in:

Minerals (2075-163X), 2020, v. 10, n. 4, p. 368, doi. 10.3390/min10040368

By:

Zhao, Jian;
Qin, Xinzhan;
Wang, Jiamin;
He, Manchao

Publication type:

Article

How 5 f Electron Polarisability Drives Covalency and Selectivity in Actinide N‐Donor Complexes.

Published in:

Chemistry - A European Journal, 2021, v. 27, n. 72, p. 18058, doi. 10.1002/chem.202102849

By:

Köhler, Luisa;
Patzschke, Michael;
Schmidt, Moritz;
Stumpf, Thorsten;
März, Juliane

Publication type:

Article

Bond Length Alternation Observed Experimentally: The Case of 1H‐Indazole.

Published in:

Chemistry - A European Journal, 2019, v. 25, n. 43, p. 10172, doi. 10.1002/chem.201901666

By:

Uriarte, Iciar;
Reviriego, Felipe;
Calabrese, Camilla;
Elguero, José;
Kisiel, Zbigniew;
Alkorta, Ibon;
Cocinero, Emilio J.

Publication type:

Article

Whole-exome sequencing expands the roles of novel mutations of organic anion transporting polypeptide, ATP-binding cassette transporter, and receptor genes in intrahepatic cholestasis of pregnancy.

Published in:

Frontiers in Genetics, 2022, v. 13, p. 1, doi. 10.3389/fgene.2022.941027

By:

Xianxian Liu;
Jiusheng Zheng;
Siming Xin;
Yang Zeng;
Xiaoying Wu;
Xiaoming Zeng;
Hua Lai;
Yang Zou

Publication type:

Article

First‐Principles Calculations of Pressure Effects on the Structural, Electronic, Elastic, and Thermodynamic Properties of Rb2MF6 (M = Si, Ni, Pd) Crystals.

Published in:

Physica Status Solidi (B), 2022, v. 259, n. 6, p. 1, doi. 10.1002/pssb.202100607

By:

Brik, Mikhail G.;
Piasecki, Michal;
Avram, Nicolae M.

Publication type:

Article

Liquid Structure of Iron and Iron–Nitrogen–Carbon Alloys Within the Cores of Small Terrestrial Bodies.

Published in:

Journal of Geophysical Research. Planets, 2025, v. 130, n. 1, p. 1, doi. 10.1029/2024JE008599

By:

Pease, Allison;
Liu, Jiachao;
Lv, Mingda;
Piper, Jack;
Kono, Yoshio;
Dorfman, Susannah M.

Publication type:

Article

波形钢板-橡胶界面黏结滑移性能.

Published in:

Acta Materiae Compositae Sinica, 2025, v. 42, n. 4, p. 2235, doi. 10.13801/j.cnki.fhclxb.20240824.004

By:

王威;
柳国良;
李昱;
周强;
陈杰

Publication type:

Article

Synthesis, Crystal Structure and Hirshfeld Surface Analysis of Bis(Benzene-1,2-Diamie)-Bis(2,4-Dihidroxybenzoato)-Nickel, [Ni(C6H8N2)2(C7H5O4)2].

Published in:

Journal of Chemical Crystallography, 2025, v. 55, n. 2, p. 147, doi. 10.1007/s10870-025-01046-5

By:

Tashkulov, Abdukadir Kh.;
Turaev, Khayit Kh.;
Ashurov, Jamshid M.;
o'g'li, Ahatov Alisher Ashur;
Khurramovich, Bekmurod A.;
Ibragimov, Aziz B.;
Xia, Changkun;
Hossain, Abul Monsur Showkot

Publication type:

Article

Development of Large High-Strength Headed Reinforcing Bars.

Published in:

ACI Structural Journal, 2025, v. 122, n. 3, p. 187, doi. 10.14359/51744381

By:

Banaeipour, Ali;
Darwin, David;
O'Reilly, Matthew;
Lepage, Andrés

Publication type:

Article

Uncertainties of recalculated bond lengths, angles and polyhedral volumes as implemented in the Crystal Palace program for parametric crystal structure analysis.

Published in:

Acta Crystallographica. Section A, Foundations & Advances, 2025, v. 81, n. 3, p. 202, doi. 10.1107/S2053273325002682

By:

Angel, Ross J.;
Mazzucchelli, Mattia L.;
Baratelli, Lisa;
Schweinle, Catherine F.;
Balić-Žunić, Tonci;
Gonzalez-Platas, Javier;
Alvaro, Matteo

Publication type:

Article

Density Functional Studies of Hydroxychloroquine and Chloroquine Reveals Higher Reactivity and Potential of Anionic Form of Hydroxychloroquine.

Published in:

Macromolecular Symposia, 2023, v. 407, n. 1, p. 1, doi. 10.1002/masy.202100466

By:

Kumar, Harsh;
Sehrawat, Rajeev;
Tyagi, Deepak;
Mittal, Rashmi;
Gupta, Bhupesh;
Pandey, S. P.;
Singh, O. P.;
Sharma, A. K.

Publication type:

Article

Understanding the Excited State Intramolecular Proton Transfer Phenomena of 2‐Hydroxy‐3‐Naphthaldehyde Thiosemicarbazone.

Published in:

Macromolecular Symposia, 2023, v. 407, n. 1, p. 1, doi. 10.1002/masy.202100375

By:

Sil, Akash;
Mukhopadhyay, Madhumita;
Bose, Debosreeta

Publication type:

Article

Correlation Between Molecular Charge Properties and Impact Sensitivity of Explosives: Nitrobenzene Derivatives.

Published in:

Propellants, Explosives, Pyrotechnics, 2021, v. 46, n. 2, p. 309, doi. 10.1002/prep.202000233

By:

Siqueira Soldaini Oliveira, Roberta;
Borges, Itamar

Publication type:

Article

Two‐Positron‐bonded Dihalides: Ps2XY (X, Y=F, Cl, Br).

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 70, p. 1, doi. 10.1002/chem.202402618

By:

Archila‐Peña, David;
Moncada, Felix;
Charry, Jorge;
do N. Varella, Marcio T.;
Flores‐Moreno, Roberto;
Torres, F. Javier;
Reyes, Andrés

Publication type:

Article

Why Are Some Pnictogen(III) Pincer Complexes Planar and Others Pyramidal?

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 57, p. 1, doi. 10.1002/chem.202402851

By:

Hannah, Tyler J.;
Kirsch, Tamina Z.;
Chitnis, Saurabh S.

Publication type:

Article

Solvent Effect on Dative and Ionic Bond Strengths: A Unified Theory from Potential Analysis and Valence‐Bond Computations.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 53, p. 1, doi. 10.1002/chem.202402008

By:

Peng, Xinru;
Li, Jiayao;
Fan, Yakun;
Wang, Xubin;
Yin, Shiwei;
Wang, Changwei;
Mo, Yirong

Publication type:

Article

Coinage Metal Complexes of a Sterically Encumbered Anionic Pyridylborate.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 48, p. 1, doi. 10.1002/chem.202401204

By:

Vanga, Mukundam;
Muñoz‐Castro, Alvaro;
Dias, H. V. Rasika

Publication type:

Article

Multiple Bonding in AeN− (Ae=Ca, Sr, Ba).

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 34, p. 1, doi. 10.1002/chem.202400714

By:

Cui, Li‐Juan;
Liu, Yu‐Qian;
Wang, Meng‐Hui;
Yan, Bing;
Pan, Sudip;
Cui, Zhong‐Hua;
Frenking, Gernot

Publication type:

Article

Cover Feature: Synthesis, Reactivity, and Complexation with Fe(0) of a Tight‐bite Bis(N‐heterocyclic silylene) (Chem. Eur. J. 31/2024).

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 31, p. 1, doi. 10.1002/chem.202401633

By:

Hendi, Zohreh;
Pandey, Madhusudan K.;
Rachuy, Katharina;
Singh, Mukesh K.;
Herbst‐Irmer, Regine;
Stalke, Dietmar;
Roesky, Herbert W.

Publication type:

Article

Synthesis, Reactivity, and Complexation with Fe(0) of a Tight‐bite Bis(N‐heterocyclic silylene).

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 31, p. 1, doi. 10.1002/chem.202400389

By:

Hendi, Zohreh;
Pandey, Madhusudan K.;
Rachuy, Katharina;
Singh, Mukesh K.;
Herbst‐Irmer, Regine;
Stalke, Dietmar;
Roesky, Herbert W.

Publication type:

Article

N,N'‐Diaryl‐Sulfurdiimides are Strongly Redox Tuned.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 26, p. 1, doi. 10.1002/chem.202400563

By:

Hill, Nathan D. D.;
Boeré, René T.

Publication type:

Article

Pyridine Iodine(I) Cations: Kinetic Trapping as a Sulfonate Complexes.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 16, p. 1, doi. 10.1002/chem.202304178

By:

Puttreddy, Rakesh;
Kumar, Parveen;
Rissanen, Kari

Publication type:

Article

Preparation of a Compound with a SiII−SiIV−SiII Bonding Arrangement.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 14, p. 1, doi. 10.1002/chem.202303113

By:

Kushvaha, Saroj Kumar;
Kallenbach, Paula;
Gorantla, Sai Manoj N. V. T.;
Herbst‐Irmer, Regine;
Stalke, Dietmar;
Roesky, Herbert W.

Publication type:

Article

Stabilization of Diborynes versus Destabilization of Diborenes by Coordination of Lewis Bases: Unravelling the Dichotomy.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 8, p. 1, doi. 10.1002/chem.202303185

By:

de Azevedo Santos, Lucas;
Trujillo‐González, Daniel E.;
Jiménez‐Halla, J. Oscar C.;
Bickelhaupt, F. Matthias;
Solà, Miquel

Publication type:

Article

Electronic Effects in Phosphino‐Iminophosphorane PdII Complexes upon Varying the N Substituent.

Published in:

Chemistry - A European Journal, 2024, v. 30, n. 5, p. 1, doi. 10.1002/chem.202303350

By:

Popovici, Ingrid;
Lognon, Elise;
Casaretto, Nicolas;
Monari, Antonio;
Auffrant, Audrey

Publication type:

Article

The Challenging World of Simple Inorganic Rings: Revisiting Roesky's Ketone and Roesky's Sulfoxide.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 67, p. 1, doi. 10.1002/chem.202302449

By:

Cunha, Ana V.;
Havenith, Remco W. A.;
Van Alsenoy, Christian;
Blockhuys, Frank

Publication type:

Article

Synthesis and Reactivity of Hetero‐Pnictogen Diazonium Analogs Stabilized by Transition Metal Units.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 61, p. 1, doi. 10.1002/chem.202301974

By:

Zimmermann, Lisa;
Riesinger, Christoph;
Balázs, Gábor;
Scheer, Manfred

Publication type:

Article

Mixed‐Valence Tetrametallic Iridium Chains.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 52, p. 1, doi. 10.1002/chem.202301438

By:

Pilar del Río, M.;
Villarroya, B. Eva;
López, José A.;
Geer, Ana M.;
Lahoz, Fernando J.;
Ciriano, Miguel A.;
Tejel, Cristina

Publication type:

Article

Reactivity of [AuF3(SIMes)]: Pathway to Unprecedented Structural Motifs.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 51, p. 1, doi. 10.1002/chem.202301684

By:

Winter, Marlon;
Ellwanger, Mathias A.;
Limberg, Niklas;
Pérez‐Bitrián, Alberto;
Voßnacker, Patrick;
Steinhauer, Simon;
Riedel, Sebastian

Publication type:

Article

Infrared Spectroscopic and Theoretical Investigations of Group 13 Oxyfluorides OMF2 and OMF (M=B, Al, Ga, In).

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 49, p. 1, doi. 10.1002/chem.202301676

By:

Wen, Mei;
Medel, Robert;
Deng, Guohai;
Tsegaw, Yetsedaw A.;
Lu, Yan;
Riedel, Sebastian

Publication type:

Article

A Playground for Heavy Atom Tunnelling: Neutral Substitutional Defect Rearrangement from Diamondoids to Diamonds.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 36, p. 1, doi. 10.1002/chem.202300673

By:

Sedgi, Itzhak;
Kozuch, Sebastian

Publication type:

Article

Reversing the Bond Length Alternation Order in Conjugated Polyenes by Substituent Effects.

Published in:

Chemistry - A European Journal, 2023, v. 29, n. 15, p. 1, doi. 10.1002/chem.202203538

By:

Yanai, Hikaru;
Terajima, Yoshihiko;
Kleemiss, Florian;
Grabowsky, Simon;
Matsumoto, Takashi

Publication type:

Article

SMM Behaviour of the Butterfly {CrIII2DyIII2} Pivalate Complex and Magneto‐structurally Correlated Relaxation Thermal Barrier.

Published in:

Chemistry - A European Journal, 2022, v. 28, n. 59, p. 1, doi. 10.1002/chem.202201450

By:

Mecchia Ortiz, Juan H.;
Cabrosi, Daiana;
Carrella, Luca M.;
Rentschler, Eva;
Alborés, Pablo

Publication type:

Article

Double‐σ‐Bonded Close‐Shell Dimers and Peroxy‐Linked Open‐Shell Dimer Derived from a C3 Symmetric Trioxophenalenyl Neutral Diradical.

Published in:

Chemistry - A European Journal, 2022, v. 28, n. 52, p. 1, doi. 10.1002/chem.202201426

By:

Murata, Tsuyoshi;
Yoshida, Kenta;
Suzuki, Shuichi;
Ueda, Akira;
Nishida, Shinsuke;
Kawai, Junya;
Fukui, Kozo;
Sato, Kazunobu;
Takui, Takeji;
Nakasuji, Kazuhiro;
Morita, Yasushi

Publication type:

Article