The first structural characterization and determination of the isomerization activation parameters of a chiral phosphatitanocene
Literature Information
T. Keith Hollis, Yi Joon Ahn, Fook S. Tham
The activation parameters (ΔG‡298 = 11.5 (±1.0) kcal mol−1, ΔH‡ = 16.3 (±3.0) kcal mol−1, ΔS‡ = 16 (±11) cal mol−1 K−1) have been determined for the rac to meso isomerization of a phosphametallocene, bis(3,4-dimethyl-2-phenylphospholyl)titanium dichloride, 2, which has been structurally characterized.
Related Literature
Prediction of the standard potentials for one-electron oxidation of N,N,N′,N′ tetrasubstituted p-phenylenediamines by calculation
Cecilie L. Andersen, Evanildo G. Lacerda, Jr, Jørn B. Christensen, Stephan P. A. Sauer, Ole Hammerich
DOI: 10.1039/D1CP02315B
Bayesian phase difference estimation: a general quantum algorithm for the direct calculation of energy gaps
Chikako Sakai, Kazuo Toyota, Kazunobu Sato, Daisuke Shiomi
DOI: 10.1039/D1CP03156B
Self-consistent field modeling of mesomorphic phase changes of monoolein and phospholipids in response to additives
N. de Lange, J. M. Kleijn, F. A. M. Leermakers
DOI: 10.1039/D1CP00697E
Glass transition and dynamics of semiflexible polymer brushes
Jian-Hua Huang, Dan-Dan Sun, Rong-Xing Lu
DOI: 10.1039/D1CP00089F
NMR study on the cellulose dissolution mechanism in CaCl2·6H2O–LiCl molten salt hydrate
Rui Tang, Ling Han, Jing Yang, Min Xu, Min Ge, Yuanyuan Tang, Xiaobin Fu, Hongtao Liu, Yuan Qian
DOI: 10.1039/D1CP02769G
First principles investigations on the controversy of structural phase transitions in thorium dialuminide under pressure
Ashok K. Verma, P. Modak
DOI: 10.1039/D1CP01771C
Origin of the hydrophobicity of sulfur-containing iron surfaces
Hao Li, Weijie Yang, Chongchong Wu, Jiang Xu
DOI: 10.1039/D1CP00588J
Investigation of the thermal decomposition mechanism of glycerol: the combination of a theoretical study based on the Minnesota functional and experimental support
Dongdong Zhang, Yi Cao, Pan Zhang, Jiankang Liang, Ke Xue, Yong Xia, Zhengjian Qi
DOI: 10.1039/D1CP01526E
Salt bridge dynamics in protein/DNA recognition: a comparative analysis of Elk1 and ETV6
Tam D. Vo, Amelia L. Schneider
DOI: 10.1039/D1CP01568K
First principles characterisation of bio–nano interface
Ian Rouse, David Power, Erik G. Brandt, Matthew Schneemilch, Konstantinos Kotsis, Nick Quirke, Alexander P. Lyubartsev, Vladimir Lobaskin
DOI: 10.1039/D1CP01116B
You might also like
What is the market or research trend for N-(4-Methoxybenzyl)-2-pyridinamine (CAS: 52818-63-0)?
N-(4-Methoxybenzyl)-2-pyridinamine (CAS: 52818-63-0) is increasingly being used ...
What precautions should be taken when handling Ethyl 4-(2-chlorophenyl)-1,3-thiazole-2-carboxylate (CAS: 1050507-06-6)?
When handling Ethyl 4-(2-chlorophenyl)-1,3-thiazole-2-carboxylate, appropriate p...
What regulatory guidelines apply to diethyldiselane (CAS: 628-39-7)?
Diethyldiselane (CAS: 628-39-7) is classified under the Globally Harmonized Syst...
What is the market or research trend for oxocopper (CAS: 12053-18-8)?
The market for oxocopper (CAS: 12053-18-8) is primarily driven by its use in cat...
What is the market or research trend for 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.4]heptane-7-carboxylic acid?
The market for 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.4]heptane-7-c...
What is 2-(1-Pyrrolidinyl)-4-pyridinamine (CAS: 35981-63-6)?
2-(1-Pyrrolidinyl)-4-pyridinamine is a chemical compound with the CAS number 359...
What are the physical and chemical properties of 2-(3-Pyridinyl)-1-azabicyclo[2.2.2]octane (CAS: 91556-75-1)?
2-(3-Pyridinyl)-1-azabicyclo[2.2.2]octane (CAS: 91556-75-1) is a crystalline sol...
How is (S)-Alpha-allyl-proline hydrochloride (CAS: 129704-91-2) typically synthesized?
(S)-Alpha-allyl-proline hydrochloride is usually synthesized via a Wittig reacti...
What is 3-Methyl-1,2-oxazole-5-carboxylic acid (CAS: 4857-42-5)?
3-Methyl-1,2-oxazole-5-carboxylic acid (CAS: 4857-42-5) is an organic compound w...
How is Lys-SMCC-DM1 (CAS: 1281816-04-3) typically synthesized?
Lys-SMCC-DM1 is synthesized via a multi-step process involving the coupling of S...
Source Journal
Chemical Communications

ChemComm publishes urgent research which is of outstanding significance and interest to experts in the field, while also appealing to the journal’s broad chemistry readership. Our communication format is ideally suited to short, urgent studies that are of such importance that they require accelerated publication. Our scope covers all topics in chemistry, and research at the interface of chemistry and other disciplines (such as materials science, nanoscience, physics, engineering and biology) where there is a significant novelty in the chemistry aspects. Major topic areas covered include: Analytical Chemistry Catalysis Chemical Biology and medicinal chemistry Computational Chemistry and Machine Learning Energy and sustainable chemistry Environmental Chemistry Green Chemistry Inorganic Chemistry Materials Chemistry Nanoscience Organic Chemistry Physical Chemistry Polymer Chemistry Supramolecular Chemistry










![1-[6-(1H-Imidazol-1-yl)-3-pyridinyl]methanamine structure 1-[6-(1H-Imidazol-1-yl)-3-pyridinyl]methanamine structure](https://static.chemtradehub.com/structs/914/914637-08-4-8825.webp)



