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How does Monte Carlo simulation help in understanding the phase transitions of a substance, and how can it be applied to predict the behavior of a liquid-solid transition of a molecule at different temperatures?

asked Feb 13 in Computational Chemistry by JulianKnetes (2.0k points)

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How does the energy transfer process occur between molecules in a gas-phase reaction and what factors affect the rate of this transfer as studied by molecular dynamics simulations in quantum chemistry?

asked Feb 13 in Quantum Chemistry by DillonLeight (1.6k points)

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What is the molecular structure of pyridine and how does its electron density distribution affect its chemical reactivity and properties as a heterocyclic compound?

asked Feb 14 in Organic Chemistry by MathewForman (1.6k points)

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What is the net number of ATP molecules generated through oxidative phosphorylation in the Citric Acid Cycle, starting with one molecule of acetyl-CoA?

asked Feb 14 in BioChemistry by ZitaHarrell8 (1.8k points)

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How does reactant orientation affect the reaction rate in the reaction between hydrogen gas and iodine gas?

asked Feb 14 in Chemical kinetics by AllanKew2295 (2.0k points)

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How does quantum coherence and entanglement affect the electronic and magnetic properties of a specific molecular or nanoscale system, and what experimental techniques can be used to measure these properties?

asked Feb 14 in Quantum Chemistry by Robin6937080 (1.9k points)

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What is the structural difference between the heterocyclic compounds pyridine and pyrrole, and how does it affect their physical and chemical properties?

asked Feb 14 in Organic Chemistry by JaneenBarrie (1.6k points)

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What is the boiling point trend of primary, secondary, and tertiary amines in comparison to their respective alkanes with the same molecular weight? Provide an explanation for the observed trend using intermolecular forces.

asked Feb 14 in Organic Chemistry by CoreyBeck54 (2.2k points)

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1 answer 105 views

How can the use of prodrugs be optimized in the development of novel treatments for gastrointestinal diseases?

asked Feb 14 in Medicinal Chemistry by ChuWegener2 (2.1k points)

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What is the role of Rubisco in the carbon fixation process during photosynthesis? How does its structure and function relate to its efficiency in fixing carbon dioxide?

asked Feb 14 in BioChemistry by KristeenBras (2.0k points)

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How do POPs affect the food web and what are the potential risks of consuming contaminated organisms?

asked Feb 14 in Environmental Chemistry by VonnieMyers6 (2.1k points)

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What are the optical properties of liquid crystals and how are they used in modern display technologies like LCDs?

asked Feb 13 in Physical Chemistry by MichelleHall (2.0k points)

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How can we use quantum chemistry to predict the catalytic activity and selectivity of a particular catalyst in a chemical reaction?

asked Feb 14 in Quantum Chemistry by BobBar745884 (1.9k points)

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What is the effect of increasing the temperature on the ionization constant (Ka) of acetic acid (CH3COOH) which initially has a Ka value of 1.8 x 10^-5 M at 25°C and how does it affect the pH of its 0.1 M solution?

asked Feb 13 in Chemical equilibrium by MartyLeSouef (2.0k points)

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What is the difference between primary, secondary, and tertiary amines, and how does their basicity compare? Additionally, give an example of a common amine that is used in everyday products and explain its function.

asked Feb 14 in Organic Chemistry by Lizzie32E683 (1.8k points)

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What is the role of metal complexes in the process of photosynthesis? Discuss the photochemical properties that make certain metal complexes better suited for this process and how they contribute to the conversion of light energy into chemical energy.

asked Feb 13 in PhotoChemistry by TiaMuirden46 (2.3k points)

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1 answer 119 views

What is the coordination geometry and metal-ligand bonding in the metallofullerene La2@C80? How does it differ from the bonding in LaC2@C80?

asked Feb 13 in Coordination Chemistry by RemonaPinto (1.8k points)

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1 answer 136 views

What is the hybridization of the central atom in the molecule SF6?

asked Feb 13 in Inorganic Chemistry by JulianKnetes (2.0k points)

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What is the effect of molecular orientation on the reaction rate of a chemical reaction between magnesium and hydrochloric acid?

asked Feb 13 in Chemical kinetics by Eusebia94K98 (2.2k points)

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What is the difference between primary, secondary, and tertiary amines? Provide an example of each one and explain how their properties and reactivity vary.

asked Feb 14 in Organic Chemistry by CorrinePerre (2.1k points)

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