Input interpretation
O_2 oxygen + CH_3CO_2H acetic acid ⟶ H_2O water + CO_2 carbon dioxide
Balanced equation
Balance the chemical equation algebraically: O_2 + CH_3CO_2H ⟶ H_2O + CO_2 Add stoichiometric coefficients, c_i, to the reactants and products: c_1 O_2 + c_2 CH_3CO_2H ⟶ c_3 H_2O + c_4 CO_2 Set the number of atoms in the reactants equal to the number of atoms in the products for O, C and H: O: | 2 c_1 + 2 c_2 = c_3 + 2 c_4 C: | 2 c_2 = c_4 H: | 4 c_2 = 2 c_3 Since the coefficients are relative quantities and underdetermined, choose a coefficient to set arbitrarily. To keep the coefficients small, the arbitrary value is ordinarily one. For instance, set c_2 = 1 and solve the system of equations for the remaining coefficients: c_1 = 2 c_2 = 1 c_3 = 2 c_4 = 2 Substitute the coefficients into the chemical reaction to obtain the balanced equation: Answer: | | 2 O_2 + CH_3CO_2H ⟶ 2 H_2O + 2 CO_2
Structures
+ ⟶ +
Names
oxygen + acetic acid ⟶ water + carbon dioxide
Reaction thermodynamics
Gibbs free energy
| oxygen | acetic acid | water | carbon dioxide molecular free energy | 231.7 kJ/mol | -389.9 kJ/mol | -237.1 kJ/mol | -394.4 kJ/mol total free energy | 463.4 kJ/mol | -389.9 kJ/mol | -474.2 kJ/mol | -788.8 kJ/mol | G_initial = 73.5 kJ/mol | | G_final = -1263 kJ/mol | ΔG_rxn^0 | -1263 kJ/mol - 73.5 kJ/mol = -1337 kJ/mol (exergonic) | | |
Entropy
| oxygen | acetic acid | water | carbon dioxide molecular entropy | 205 J/(mol K) | 160 J/(mol K) | 69.91 J/(mol K) | 214 J/(mol K) total entropy | 410 J/(mol K) | 160 J/(mol K) | 139.8 J/(mol K) | 428 J/(mol K) | S_initial = 570 J/(mol K) | | S_final = 567.8 J/(mol K) | ΔS_rxn^0 | 567.8 J/(mol K) - 570 J/(mol K) = -2.18 J/(mol K) (exoentropic) | | |
Equilibrium constant
Construct the equilibrium constant, K, expression for: O_2 + CH_3CO_2H ⟶ H_2O + CO_2 Plan: • Balance the chemical equation. • Determine the stoichiometric numbers. • Assemble the activity expression for each chemical species. • Use the activity expressions to build the equilibrium constant expression. Write the balanced chemical equation: 2 O_2 + CH_3CO_2H ⟶ 2 H_2O + 2 CO_2 Assign stoichiometric numbers, ν_i, using the stoichiometric coefficients, c_i, from the balanced chemical equation in the following manner: ν_i = -c_i for reactants and ν_i = c_i for products: chemical species | c_i | ν_i O_2 | 2 | -2 CH_3CO_2H | 1 | -1 H_2O | 2 | 2 CO_2 | 2 | 2 Assemble the activity expressions accounting for the state of matter and ν_i: chemical species | c_i | ν_i | activity expression O_2 | 2 | -2 | ([O2])^(-2) CH_3CO_2H | 1 | -1 | ([CH3CO2H])^(-1) H_2O | 2 | 2 | ([H2O])^2 CO_2 | 2 | 2 | ([CO2])^2 The equilibrium constant symbol in the concentration basis is: K_c Mulitply the activity expressions to arrive at the K_c expression: Answer: | | K_c = ([O2])^(-2) ([CH3CO2H])^(-1) ([H2O])^2 ([CO2])^2 = (([H2O])^2 ([CO2])^2)/(([O2])^2 [CH3CO2H])
Rate of reaction
Construct the rate of reaction expression for: O_2 + CH_3CO_2H ⟶ H_2O + CO_2 Plan: • Balance the chemical equation. • Determine the stoichiometric numbers. • Assemble the rate term for each chemical species. • Write the rate of reaction expression. Write the balanced chemical equation: 2 O_2 + CH_3CO_2H ⟶ 2 H_2O + 2 CO_2 Assign stoichiometric numbers, ν_i, using the stoichiometric coefficients, c_i, from the balanced chemical equation in the following manner: ν_i = -c_i for reactants and ν_i = c_i for products: chemical species | c_i | ν_i O_2 | 2 | -2 CH_3CO_2H | 1 | -1 H_2O | 2 | 2 CO_2 | 2 | 2 The rate term for each chemical species, B_i, is 1/ν_i(Δ[B_i])/(Δt) where [B_i] is the amount concentration and t is time: chemical species | c_i | ν_i | rate term O_2 | 2 | -2 | -1/2 (Δ[O2])/(Δt) CH_3CO_2H | 1 | -1 | -(Δ[CH3CO2H])/(Δt) H_2O | 2 | 2 | 1/2 (Δ[H2O])/(Δt) CO_2 | 2 | 2 | 1/2 (Δ[CO2])/(Δt) (for infinitesimal rate of change, replace Δ with d) Set the rate terms equal to each other to arrive at the rate expression: Answer: | | rate = -1/2 (Δ[O2])/(Δt) = -(Δ[CH3CO2H])/(Δt) = 1/2 (Δ[H2O])/(Δt) = 1/2 (Δ[CO2])/(Δt) (assuming constant volume and no accumulation of intermediates or side products)
Chemical names and formulas
| oxygen | acetic acid | water | carbon dioxide formula | O_2 | CH_3CO_2H | H_2O | CO_2 Hill formula | O_2 | C_2H_4O_2 | H_2O | CO_2 name | oxygen | acetic acid | water | carbon dioxide IUPAC name | molecular oxygen | acetic acid | water | carbon dioxide