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Stoichiometry

Stoichiometry. Atomic Mass The Mole concept Molar Mass Percent Composition of Compounds Determination of Formula of Compounds Writing and Balancing Chemical Equations Interpreting balance equations, and Reaction Stoichiometry and Calculations. Atomic Masses.

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Stoichiometry

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  1. Stoichiometry • Atomic Mass • The Mole concept • Molar Mass • Percent Composition of Compounds • Determination of Formula of Compounds • Writing and Balancing Chemical Equations • Interpreting balance equations, and • Reaction Stoichiometry and Calculations

  2. Atomic Masses • Absolute masses of atoms cannot be obtained – too small to measure the mass directly; • Relative atomic masses are used instead – masses relative to a chosen standard or reference. • Carbon-12 is used as atomic mass reference – it is assigned an atomic mass of 12 u exactly; • Other atoms are assigned masses relative to that of carbon-12; • Relative atomic masses are determined using mass spectrometer;

  3. A Schematic Diagram of Mass Spectrophotometer

  4. Isotope Mass of CO2

  5. Mass Spectrum of Chlorine

  6. Atomic Mass Spectrum of Mercury

  7. Calculation of Relative Atomic Masses Example-1: An atomic mass spectrum gives atomic mass ratio of oxygen atom to carbon-12 as 1.3329:1. If the atomic mass of carbon-12 is exactly 12 u, what is the atomic mass of oxygen? Atomic mass of oxygen = 1.3329 x 12 u = 15.995 u

  8. Calculation of Average Atomic Masses Example-2: Chlorine is composed of two stable naturally occurring isotopes: chlorine-35 (75.76%; 34.9689 u) and chlorine-37 (24.24%; 36.9659 u). What is the average atomic mass of copper? Atomic mass of chlorine = (0.7576 x 34.9689 u) + (0.2424 x 36.9659 u) = 35.45 u(as given in the periodic table)

  9. Calculation of Average Atomic Masses • Example-3: Copper is composed of two naturally occurring isotopes: copper-63 (69.09%; 62.93 u) and copper-65 (30.91%; 64.93 u). What is the average atomic mass of copper? Atomic mass of copper = (0.6909 x 62.93 u) + (0.3091 x 64.93 u) = 63.55 u(as given in the periodic table)

  10. Exercise #1: Relative Atomic Mass A mass spectrometer computed the atomic mass ratio of fluorine to carbon-12 as 1.5832-to-1. If the atomic mass of carbon-12 is 12 u (exactly), what is the atomic mass of fluorine in u? (Answer: 18.998 u)

  11. Exercise #2: Average Atomic Mass Natural boron is composed of two isotopes: 19.78% boron-10 (atomic mass = 10.0129 amu) and 80.22% boron-11 (atomic mass = 11.0093 amu). What is the average atomic mass of naturally occurring boron? (Answer: 10.81 u)

  12. Molar Quantity • The Mole: A quantity that contains the Avogadro’s number of items; Avogadro’s number = 6.022 x 1023 12.01 g of carbon contains the Avogadro’s number of carbon atoms. 1 mole of carbon = 12.01 g 1 carbon atom = 12.01 u (or amu)

  13. Gram-Atomic Mass • Mass of 1 carbon-12 atom = 12 u (exactly); • Mass of 1 mole of carbon-12 = 12 g; • Mass of 1 oxygen atom = 16.00 u • Mass of 1 mole of oxygen = 16.00 g • Gram-atomic mass = mass (in grams) of 1 mole of an element – that is, the mass (in grams) that contains the Avogadro’s number of atoms of that element. • gram-atomic massisthe molar mass of an element in grams.

  14. Atomic Mass & Molar Mass • Examples: Element Atomic mass Gram-atomic mass Carbon 12.01 u 12.01 g/mol Oxygen 16.00 u 16.00 g/mol Aluminum 26.98 u 26.98 g/mol Silicon 28.09 u 28.09 g/mol Gold 197.0 u 197.0 g/mol

  15. Molecular Mass and Molar Mass • Molecular mass = the mass of a molecule in u; • Molar mass = the mass of one mole of an element or a compound, expressed in grams. • Examples: Molecular Mass Molar Mass N2 28.02 u 28.02 g/mol H2O 18.02 u 18.02 g/mol C8H18 114.22 u 114.22 g/mol

  16. Calculating Molar Mass • Calculating the molar mass of sucrose, C12H22O11: (12 x 12.01 g) + (22 x 1.008 g) + (11 x 16.00 g) = 342.3 g/mole • Molar mass of ammonium hydrogen phosphate, (NH4)2HPO4: (2 x 14.01 g) + (9 x 1.008 g) + (1 x 30.97 g) + (4 x 16.00 g) = 132.06 g/mole

  17. Percent Composition of a Compound • Composition of aluminum sulfate, Al2(SO4)3: • Molar mass of Al2(SO4)3 = (2 x 26.98 g) + (3 x 32.06 g) + (12 x 16.00 g) = 342.14 g/mole Mass percent of Al = (53.96 g/342.14 g) x 100% = 15.77% Mass percent of S = (96.18 g/342.14 g) x 100% = 28.11% Mass percent of O = (192.0 g/342.14 g) x 100% = 56.12%

  18. Formula of Compounds • Empirical Formula A chemical formula that represents a simple whole number ratio of the number of moles of elements in the compound. Examples: MgO, Cu2S, CH2O, etc. • Molecular Formula A formula that shows the actual number of atoms of each type in a molecule. Examples: C4H10, C6H6, C6H12O6.

  19. Empirical Formula-1 • Empirical formula from composition: Example: A compound containing carbon, hydrogen, and oxygen has the following composition (by mass percent): 68.12% C, 13.73% H, and 18.15% O, Determine its empirical formula. • Solution: Use mass percent to calculate mole and mole ratio of C:H:O • Mole of C = 68.12 g x (1 mol C/12.01 g) = 5.672 mol C • Mole of H = 13.73 g x (1 mol H/1.008 g) = 13.62 mol H • Mole of O = 18.15 g x (1 mol O/16.00 g) = 1.134 mol O Divide all moles by mole of O (smallest value) to get simple ratio: 5.672 mol C/1.134 mol O = 5; 13.62 mol H/1.134 mol O = 12, and 1.134 mol O/1.134 mol O = 1; Mole ratio: 5C:12H:1O  Empirical formula = C5H12O

  20. Empirical Formula-2 • Empirical formula from mass of elements in a sample of compound Example: When 1.96 g of phosphorus is burned, 4.49 g of a phosphorus oxide is obtained. Calculate the empirical formula of the phosphorus oxide. • Solution: Calculate moles of P and O in sample and obtain a simple mole ratio; Mole of P = 1.96 g P x (1 mol/30.97 g) = 0.0633 mol P; Mole of O = (4.49 g – 1.96 g) x (1 mol/16.00 g) = 0.158 mol O; Divide by mole of P (smaller value) to get a simple mole ratio: 0.0633 mol P/0.0633 = 1 mol P; 0.158 mol O/0.0633 = 2.5 mol O Mole ratio: 1 mol P to 2.5 mol O, OR 2 mol P to 5 mol O • Empirical formula = P2O5

  21. Empirical Formula-3 • Empirical formula from data of combustion reaction: Example: A compound is composed of carbon, hydrogen, and oxygen. When 2.32 g of this compound is burned in excess of oxygen, it produces 5.28 g of CO2 gas and 2.16 g of water. Calculate the composition (in mass percent) of the compound and determine its empirical formula. • Solution: • Find mass of C, H, and O in the sample and then calculate their mass percent: Mass of C = 5.28 g CO2 x (12.01 g C/44.01 g CO2) = 1.44 g Mass % of C = (1.44 g C/2.32 g sample) x 100% = 62.1% Mass of H = 2.16 g H2O x (2 x 1.008 g/18.02 g H2O) = 0.24 g Mass % of H = (0.242 g H/2.32 g sample) x 100% = 10.4% Mass of O = 2.32 g sample – 1.44 g C – 0.24 g H = 0.64 g Mass % of O = 100 – 62.1% C – 10.4% H = 27.5% • Derive empirical formula from these mass percent composition • (next slide)

  22. Empirical Formula-3 • Empirical formula from data of combustion (continued): • Calculate mole and simple mole ratio from calculated mass of each element: Mole of C = 1.44 g C x (1 mol/12.01 g) = 0.12 mol Mole of H = 0.242 g x (1 mol/1.008 g) = 0.24 mol Mole of O = 0.64 g x (1 mol/16.00 g) = 0.04 mol • Divide all moles by mole of O (smallest mole) to obtain a simple ratio: 0.12 mol C/0.04 = 3 mol C; 0.24 mol H/0.04 = 6 mol H; 0.04 mol O/0.04 = 1 mol O • Simple molar ratio: 3 mol C : 6 mol H : 1 mol O • Empirical formula: C3H6O

  23. Molecular Formula • Molecular formula is derived from empirical formula and molecular mass, which is obtained independently • Empirical formula = CxHyOz; molecular formula = (CxHyOz)n, where n = (molecular mass/empirical formula mass) • Example: A compound has an empirical formula C3H6O and its molecular formula is 116.2 u. What is the molecular formula? • Solution: Empirical formula mass = (2 x 12.01 u) + (6 x 1.008 u) + 16.00 u = 58.1 u Molecular formula = (C3H6O)n; where n = (116.2 u/58.1 u) = 2 Incorrect molecular formula = (C3H6O)2; • Correct molecular formula = C6H12O2

  24. Exercise #3: Determination of Formulas A 2.00-gram sample of phosphorus is completely reacted with oxygen gas, which yields 4.58 g of product that is composed of only phosphorus and oxygen. In separate analyses, the compound is found to have molar mass of about 284 g/mol. (a) Determine the empirical and molecular formulas of the compound. (b) Write an equation for the reaction of phosphorus with oxygen gas. (Answer: P2O5; P4O10; 4P + 5 O2P4O10)

  25. Chemical Equation #1 • Description of reaction: Iron reacts with oxygen gas and forms solid iron(III) oxide: • Identity: reactants = iron (Fe) and oxygen gas (O2); product = iron(III) oxide • Chemical equation: Fe(s) + O2(g) Fe2O3(s) • Balanced equation: 4Fe(s) + 3 O2(g) 2Fe2O3(s)

  26. Chemical Equation #2 • Description of reaction: Phosphorus reacts with oxygen gas to form solid tetraphosphorus decoxide. Equation: P(s) + O2(g) P4O10(s) Balanced eqn.: 4P(s) + 5 O2(g) P4O10(s)

  27. Chemical Equation #3 • Description of reaction: Propane gas (C3H8) is burned in air (excess of oxygen) to form carbon dioxide gas and water vapor; • Identity: reactants = C3H8(g) and O2(g); products = CO2(g) and H2O(g); • Equation: C3H8(g) + O2(g)CO2(g) + H2O(g); • Balanced equation: C3H8(g) + 5 O2(g) 3CO2(g) + 4H2O(g)

  28. Chemical Equation 4 • Description of reaction: Ammonia gas (NH3) reacts with oxygen gas to form nitrogen monoxide gas and water vapor; • Equation: NH3(g) + O2(g)NO(g) + H2O(g); • Balancing the equation: 2NH3(g) + 5/2 O2(g) 2NO(g) + 3H2O(g); • Multiply throughout by 2 to get rid of the fraction: • 4NH3(g) + 5 O2(g) 4NO(g) + 6H2O(g);

  29. Balancing Chemical Equations Rules for balancing equations: • Use smallest integer coefficients in front of each reactants and products as necessary; coefficient “1” need not be indicated; • The formula of the substances in the equation MUST NOT be changed. Helpful steps in balancing equations: • Begin with the compound that contains the most atoms or types of atoms. • Balance elements that appear only once on each side of the arrow. • Next balance elements that appear more than once on either side. • Balance free elements last. • Finally, check that smallest whole number coefficients are used.

  30. Stoichiometry • Stoichiometry = the quantitative relationships between one reactant to another, or between a reactant and products in a chemical reaction. • Interpreting balanced equations: Example: C3H8(g) + 5 O2(g) 3CO2(g) + 4H2O(g); • The equation implies that: 1 C3H8 molecule reacts with 5 O2 molecules to produce 3 CO2 molecules and 4 H2O molecules; OR 1 mole of C3H8 reacts with 5 moles of O2 to produce 3 moles of CO2 and 4 moles of H2O.

  31. Stoichiometric Calculations Mole-to-mole relationship: • Example: In the following reaction, if 6.0 moles of octane, C8H18, is completely combusted in excess of oxygen gas, how many moles of CO2 and H2O, respectively, will be formed? How many moles of O2 does it consumed? Reaction: 2C8H18(l) + 25 O2(g)  16CO2(g) + 18H2O(g) Calculations: • Mole CO2 formed = 6.0 mol C8H18 x (16 mol CO2/2mol C8H18) = 48 moles • Mole H2O formed = 6.0 mol C8H18 x (18 mol H2O/2mol C8H18) = 54 moles • Mole O2 consumed = 6.0 mol C8H18 x (25 mol O2/2mol C8H18) = 75 moles

  32. Stoichiometric Calculations Mass-to-mole-to-mole-to-mass relationship: • Example-1: In the following reaction, if 690 g of octane, C8H18, is completely combusted in excess of oxygen gas, how many grams of CO2 are formed? Reaction: 2C8H18(l) + 25 O2(g) 16CO2(g) + 18H2O(g) Calculation-1: • Moles C8H18 reacted = 690 g C8H18 x (1 mol/114.2 g) = 6.0 moles • Moles CO2 formed = 6.0 mol C8H18 x (16 mol CO2/2 mol C8H18) • = 48 moles CO2 • Mass of CO2 formed = 48 mol CO2 x (44.01 g/mol) = 2.1 x 103 g

  33. Stoichiometric Calculations Mass-to-mole-to-mole-to-mass relationship: • Example-2: In the following reaction, if 690 g of octane, C8H18, is completely combusted in excess of oxygen gas, how many grams of H2O are formed? Reaction: 2C8H18(l) + 25 O2(g) 16CO2(g) + 18H2O(g) Calculation-2: • Moles C8H18 reacted = 690 g C8H18 x (1 mol/114.2 g) = 6.0 moles • Moles H2O formed = 6.0 mol C8H18 x (18 mol H2O/2 mol C8H18) • = 54 moles CO2 • Mass of H2O formed = 54 mol H2O x (18.02 g/mol) = 970 g

  34. Stoichiometric Calculations Mass-to-mole-to-mole-to-mass relationship: • Example-3: In the following reaction, if 690 g of octane, C8H18, is completely combusted in excess of oxygen gas, how many grams of oxygen gas are consumed? Reaction: 2C8H18(l) + 25 O2(g) 16CO2(g) + 18H2O(g) Calculation-3: • Moles C8H18 reacted = 690 g C8H18 x (1 mol/114.2 g) = 6.0 moles • Moles O2 consumed = 6.0 mol C8H18 x (25 mol O2/2 mol C8H18) • = 75 moles O2 • Mass of H2O formed = 75 mol O2 x (32.00 g/mol) = 2.4 x 103 g

  35. Stoichiometry Involving Limiting Reactant • Limiting reactant one that got completely consumed in a chemical reaction before the other reactants. Product yields depend on the amount of limiting reactant

  36. Limiting Reactant

  37. Limiting Reactants Synthesis of H2O

  38. A Reaction Stoichiometry For example, in the synthesis reaction to produce water according to the following equation, 2H2(g) + O2(g) 2H2O(l), 2 moles of H2 are required to react completely with 1 mole of O2, in which 2 mole of H2O are formed. If a reaction is carried out with 1 mole of H2 and 1 mole of O2, H2 will be the limiting reactant and O2 will be present in excess. Only 1 mole of H2O will be produced.

  39. Synthesis of NH3

  40. Stoichiometry Calculations Ammonia is produced by the reaction of N2 with H2 according to the following equation: N2(g) + 3H2(g) 2NH3(g) (a) If 4.0 moles of N2 and 9.0 moles of H2 are reacted, which reactant will be completely consumed? (b) How many moles of NH3 are formed? (c) How many moles of the excess reactant remains after the reaction?

  41. Limiting Reactants and Reaction Yields Ammonia is produced in the following reaction: N2(g) + 3H2(g) 2NH3(g) (a) If 118 g of nitrogen gas is reacted with 31.5 g of hydrogen gas, which reactant will be completely consumed at the end of the reaction? (b) How many grams ammonia will be produced when the limiting reactant is completely reacted and the yield is 100%? (c) How many grams of the excess reactant will remain (unreacted)? (Answer: (a) N2; (b) 6.0 g; (c) 143.4 g of NH3)

  42. Theoretical, Actual and Percent Yields • Theoretical yield: yield of product calculated based on the stoichiometry of balanced equation and amount of limiting reactant (assuming the reaction goes to completion and the limiting reactant is completely consumed). • Actual Yield: Yield of product actually obtained from experiment • Percent Yield = (Actual yield/Theoretical yield) x 100%

  43. Limiting Reactant & Yields In an ammonia production, the reactor is charged with N2 and H2 gases at flow rates of 805 g and 195 g per minute, respectively, at 227oC, and the reaction is as follows: N2(g) + 3H2(g) 2 NH3(g) (a) What is the rate (in g/min) that ammonia is produced if the yield is 100%? (b) If the reaction produces 915 g of NH3 per minute, calculate the percentage yield of the reaction. (Answer: (a) 978.5 g/min; (b) Yield = 93.5%)

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