Chemical Calculations
Chemical Calculations
Chemical Calculations
CHM152S
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Chemical Calculations
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Outline
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Collection Terms
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The Mole
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A Mole of Atoms
A mole is a collection that contains
▪ the same number of particles as there are carbon
atoms in 12.0 g of carbon 12C
▪ 6.02 x 1023 atoms of an element (Avogadro’s number)
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A Mole of a Compound
A mole
▪ of a covalent compound has Avogadro’s number of
molecules
1 mole of CO2 = 6.02 x 1023 CO2 molecules
1 mole of H2O = 6.02 x 1023 H2O molecules
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Particle in One-Mole Samples
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Using Avogadro’s Number
Avogadro’s number is used to convert
moles of a substance to particles.
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Using Avogadro’s Number (continued)
Glucose
C6H12O6
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Subscripts State Atoms and Moles
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Mole Calculations
1. The number of atoms in 2.0 moles of Al is
A. 2.0 Al atoms
B. 3.0 x 1023 Al atoms
C. 1.2 x 1024 Al atoms
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Mole Calculations
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Mole Calculations
1 mol K
1.25 × 1021 atoms K × = 2.08 × 10-3 mol K
6.02 × 1023 atoms K
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Mole Calculations
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Mole Calculations
How many O atoms are in 0.150 mole of aspirin,
C9H8O4?
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Solution
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Solution (continued)
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Molar Mass
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Molar Mass
The molar mass is
▪ the mass of one mole of a
substance
▪ the atomic mass of an
element expressed in
grams
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Molar Mass
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Molar Mass
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Learning Check
Give the molar mass to the nearest 0.1 g.
A. K = ________
B. Sn = ________
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Solution
Give the molar mass to the nearest 0.1 g.
A. K = 39.1 g
B. Sn = 118.7 g
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Molar Mass of CaCl2
▪ For a compound, the molar mass is the sum of the molar
masses of the elements in the formula. We calculate the
molar mass of CaCl2 to the nearest 0.1 g as follows.
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Molar Mass of K3PO4
Determine the molar mass of K3PO4 to 0.1 g.
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Learning Check
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Learning Check
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Calculating Molar Mass
• The molar mass of a substance / compound is the sum of
the molar masses of each element in the compound.
• Example:
✓ What is the molar mass of magnesium nitrate,
Mg(NO3)2?
✓ The sum of the atomic masses is:
= 24.31 + 2(14.01) + 6(16.00) amu
= 24.31 + 28.02 + 96 amu
= 148.33 amu
• The molar mass for Mg(NO3)2 is 148.33 g/mol.
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Learning Check
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Learning Check
✓ Calciumcarbonate, CaCO3
= 40.08 + 12.01 + 3(16.00) = 100.09 g/mol
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Learning Check
Calculate the molar mass for Al(OH)3 to the nearest
0.1g.
1) 44.0 g/mole
2) 75.0 g/mole
3) 78.0 g/mole
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Solution
STEP 1 Obtain the molar mass of each element.
Al 27.0 g/mole O 16.0 g/mole
H 1.0 g/mole
STEP 2 Multiply each by the subscript in the formula.
1 mole Al x 27.0 g Al = 27.0 g
1 mole Al
3 moles O x 16.0 g O = 48.0 g
1 mole O
3 moles H x 1.0 g H = 3.0 g
1 mole H
STEP 3 Total: 1 mole of Al(OH)3 = 78.0 g (3)
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Learning Check
Prozac, C17H18F3NO, is an antidepressant that inhibits the
uptake of serotonin by the brain. What is the molar mass of
Prozac?
1) 40.0 g/mole
2) 262 g/mole
3) 309 g/mole
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Solution
3) 309 g/mole
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Solution (continued)
STEP 2 (continued)
3 moles F x 19.0 g F = 57.0 g
1 mole F
1 mole N x 14.0 g N = 14.0 g
1 mole N
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Mole Calculations II
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Mass-Mole Calculations
47.88 g Ti
1.33 mole Ti × = 63.7 g Ti
1 mole Ti
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Mass-Mole Calculations
• What is the mass of 2.55 × 1023 atoms of lead?
✓ We want grams,
✓ we have atoms of lead,
✓ Use Avogadro’s number,
✓ and the molar mass of Pb
1 mol Pb 207.2 g Pb
2.55 × 1023 atoms Pb × ×
23
6.02×10 atoms Pb 1 mole Pb
= 87.8 g Pb
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Mass-Mole Calculations
• How many O2 molecules are present in 0.470 g of oxygen
gas?
✓ We want molecules O2,
✓ we have grams O2,
✓ Use Avogadro’s number,
✓ and the molar mass of O2
1 mol O2 6.02×1023 molecules O2
0.470 g O2 × ×
32.00 g O2 1 mole O2
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Learning Check
The artificial sweetener aspartame (NutraSweet), C14H18N2O5 ,
is used to sweeten diet foods, coffee, and soft drinks. How
many moles of aspartame are present in 225 g of aspartame?
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Solution
STEP 1 Given: 225 g of aspartame, C14H18N2O5
STEP 2 Plan: g of aspartame moles of aspartame
STEP 3 Determine molar mass of aspartame:
14(12.0) + 18(1.0) + 2(14.0) + 5(16.0)
= 294 g/mole
STEP 4 Set up problem to calculate the moles of aspartame:
225 g aspartame x 1 mole aspartame
294 g aspartame
mole factor (inverted)
= 0.765 mole of aspartame
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Formula Weight
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Molecular Weight
C: 2(12.011 amu)
+ H: 6(1.00794 amu)
30.070 amu
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Learning Check
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Learning Check
• Answers
✓ Sucrose:
o FW = 12 X C amu + 22 X H amu + 11 X O amu
o FW = 12(12.01) + 22(1.008) + 11(16.00) amu
o FW = 144.12 + 22.176 + 176 amu
o FW = 342.296 amu
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Learning Check
• Answers
✓ Calcium nitrate:
o FW = 1 X Ca amu + 2 X N amu + 6 X O amu
o FW = 1(40.08) + 2(14.01) + 6(16.00) amu
o FW = 40.08 + 28.02 + 96 amu
o FW = 164.1 amu
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Learning Check
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Learning Check
• Answers
✓ Aluminium hydroxide, Al(OH)3:
o FW = 1 X Al amu + 3 X H amu + 3 X O amu
o FW = 1(26.98) + 3(1.008) + 3(16.00) amu
o FW = 26.98 + 3.024 + 48 amu
o FW = 78.004 amu
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Learning Check
• Answers
✓ Methanol, CH3OH:
o FW = 1 X C amu + 4 X H amu + 1 X O amu
o FW = 1(12.01) + 4(1.008) + 1(16.00) amu
o FW = 12.01 + 4.032 + 16 amu
o FW = 32.042 amu
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Chemical Formula
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Chemical Formula
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Writing Chemical Formulas
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Interpreting Chemical Formulas
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Interpreting Chemical Formulas
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Percent Composition
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Percent Composition
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Percent Composition
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Percent Composition
2.02 amu H
× 100% = 11.2% H
18.02 amu H2O
16.00 amu O
× 100% = 88.79% O
18.02 amu H2O
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Percent Composition
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Percent Composition
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Learning Check
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Learning Check
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Learning Check
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Learning Check
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Learning Check
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Learning Check
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Learning Check
✓ Mass of C = 0.192 g
✓ Determine the number of moles m
✓ Use the equation: n= =
mass
MM molar mass
mass 0.192 g
✓ n = molar mass = 12 g/mol
= 0.016 mol
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Learning Check
(d) 6.75 g of Al
✓ n = m/MM = 6.75 g/26.98 g/mol = 0.25 mol
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Empirical Formula
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Empirical Formula
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Calculating Empirical Formulas
• Steps:
✓ Begin by assuming you have 100 g of the substance & calculate
the mass (g) of each element.
✓ Convert the mass (g) to moles. Using atomic mass.
✓ Calculate mole ratios: divide all by the smallest number of
moles.
✓ Convert to formula ratios.
✓ You may need to multiply by small whole numbers to get
to whole number ratios.
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Calculating Empirical Formulas
Example:
A pure hydrocarbon (consisting mainly of C & H) is 85.7% C. Calculate
the empirical formula of the compound.
• %C = 85.7%;
• %H = 100 – 85.7% = 14.3%
• Assume 100.00 g of compound, then % becomes the mass in g.
Molecular formula:
• The actual molecular formula is some multiple of the
empirical formula, (CH)n.
• Find n to find the molecular formula.
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Calculating Empirical Formulas
• Benzene is 92.2% carbon and 7.83% hydrogen, what is
the empirical formula.
• Benzene has a molar mass of 78 g/mol. Find n to find the
molecular formula.
• %C = 92.2%;
• %H = 7.83%
• Assume 100.00 g of compound, then % becomes the mass in g.
1 mol
C: 92.2 g x = 7.68 mol C
12.01 g
H: 7.83 g x 1 mol = 7.77 mol H
1.008 g
• Divide the moles by the smallest number obtained = 7.68
• Thus; C = 7.68/7.68 mol = 1 mol
• H = 7.77/7.68 mol = 1.01 mol 1 mol
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Calculating Empirical Formulas
(CH)n 78 g/mol
=
CH 13 g/mol
n = 6 and the molecular
formula is C6H6.
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Learning Check
The percentage composition of fructose is 40.00% C,
6.72% H and 53.28% O. Calculate the empirical formula for
fructose.
• Assume 100 g of sample; The each % becomes the mass
1 mol
C: 40.0 g x = 3.33 mol C
12.01 g
H: 6.72 g x 1 mol = 6.67 mol H
1.008 g
O: 53.28 g x 1 mol = 3.33 mol H
16.00 g
• Ratio = C:H:O = 3.33 : 6.67 : 3.33; divide by smallest number = 3.33
• Ratio = C:H:O = 1:2:1
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Learning Check
• The percentage composition of fructose is 40.00% C,
6.72% H and 53.28% O.
✓ Calculate the empirical formula for fructose.
✓ The experimental molar mass of fructose is 180.2 g.
Calculate the molecular formula of fructose.
(CHO)n 180.2 g
= =6
CH2O 30.026 g
✓ Therefore, the molecular formula = C6H12O6
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Chemical Equations
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Chemical Equations
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What Is in a Chemical Equation?
CH4(g) + 2O2(g) CO2(g) + 2H2O(g)
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What Is in a Chemical Equation?
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Chemical Equations
✓ 2 H2 + O2 → 2 H2O
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Balancing chemical Equations
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Balancing chemical Equations
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Learning Check
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Solution
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Learning Check
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Solution
B. 3) 2, 3, 2
2Al(s) + 3Cl2(g) 2AlCl3(s)
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Equations with Polyatomic Ions
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Balancing with Polyatomic Ions
STEP 1 Write the equation with the correct formulas.
Na3PO4(aq) + MgCl2(aq) NaCl(aq) + Mg3(PO4)2(s)
STEP 3 (continued)
Balance Mg
3MgCl2(aq) Mg3(PO4)2(s)
Balance Na and Cl
3MgCl2(aq) + 2Na3PO4(aq) 6NaCl(aq) + Mg3(PO4)2(s)
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Solution
A. 2) 2, 3, 4, 3
2Fe2O3(s) + 3C(s) 4Fe(s) + 3CO2(g)
B. 1) 2, 3, 3, 1
2Al(s) + 3FeO(s) 3Fe(s) + 1Al2O3(s)
C. 2) 2, 3, 1, 3
2Al(s) + 3H2SO4(aq) 1Al2(SO4)3(aq) + 3H2(g)
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Types of Chemical Reactions
• Combination
• Involves two substances that combine to form a third
compound.
• Examples:
✓ 2 Na(s) + Cl2(g) → 2 NaCl(aq)
✓ 2Mg(s) + O2(g) ⎯⎯→ 2MgO(s)
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Types of Chemical Reactions
• Decomposition
• One compound reacts to give two or more substances
(heat usually required).
• Examples:
✓ 2 HgO(s) → 2 Hg(l) + O2(g)
✓ 2NaN3(s) ⎯⎯→ 2Na(s) + 3N2(g)
o Sodium azide is used
in air-bags of cars.
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Types of Chemical Reactions
• Displacement
• An element reacts with a compound, displacing another
element from it.
• Examples:
✓ Cu(s) + 2 AgNO3(aq) → 2 Ag(s) + Cu(NO3)2(aq)
✓ Zn(s) + 2 HCl(aq) → ZnCl2(aq) + H2(g)
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Types of Chemical Reactions
• Metathesis
• Involves the exchange of parts of the reactants.
• Examples:
✓ 2 Kl(aq) + Pb(NO3)2 → 2 KNO3(aq) + PbI2(s)
✓ HCl(aq) + NaOH(aq) → H2O(l) + NaCl(aq)
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Types of Chemical Reactions
• Combustion
• Involves the oxidation of a substance with oxygen, usually
with a rapid release of heat to produce a flame.
• Examples:
✓ 4 Fe(s) + 3 O2(g) → 2 Fe2O3(s)
✓ 2 C4H10(g) + 13 O2(g) → 8 CO2(g) + 10 H2O(l)
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Learning Check
• Classify the following type of reactions:
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Learning Check
• Classify the following type of reactions:
✓ PbS(s) + HNO3(aq) →
[Hint: metathesis, gas formation]
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Learning Check
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Mole Relationships in Chemical
Equations
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Law of Conservation of Mass
The Law of Conservation of Mass indicates
that in an ordinary chemical reaction,
▪ matter cannot be created or destroyed
▪ no change in total mass occurs in a reaction
▪ mass of products is equal to mass of
reactants
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Conservation of Mass
Reactants Products
2 moles of Ag + 1 mole of S = 1 mole Ag2S
2 (107.9 g) + 1(32.1 g) = 1 (247.9 g)
247.9 = 247.9 g
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Reading Equations with Moles
Consider the following equation:
4Fe(s) + 3O2(g) 2Fe2O3(s)
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Learning Check
How many moles of Fe are needed for the
reaction of 12.0 moles of O2?
1) 3.00 moles of Fe
2) 9.00 moles of Fe
3) 16.0 moles of Fe
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Solution
3) 16.0 moles of Fe
STEP 1 Given: 12 moles of O2
4Fe(s) + 3O2(g) 2Fe2O3(s)
Need: moles of Fe
STEP 2 Plan: moles of O2 moles of Fe
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Solution (continued)
STEP 4 Set up problem to cancel moles of O2:
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Mass Calculations for Reactions
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Guide to Calculating the Masses of
Reactants and Products
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Example of Converting Moles to Grams
STEP 2 Plan:
moles of N2 moles of NH3 grams of NH3
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Moles to Grams
STEP 3 Write conversions factors:
1 mole of N2 = 2 moles of NH3
1) 38.4 g of O2
2) 19.2 g of O2
3) 1.90 g of O2
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Solution
2) 19.2 g of O2
STEP 1 Given: 0.400 moles of Fe2O3
Need: mass (g) of O2
STEP 2 Write a plan to calculate grams of O2:
moles of Fe2O3 moles of O2 grams of O2
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Solution (continued)
STEP 3 (continued)
1 mole of O2 = 32.0 g of O2
1 mole O2 and 32.0 g O2
32.0 g O2 1 mole O2
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Learning Check
Acetylene gas, C2H2, burns in the oxyacetylene
torch for welding. How many grams of C2H2 are
burned if the reaction produces 75.0 g of CO2?
1) 88.6 g of C2H2
2) 44.3 g of C2H2
3) 22.2 g of C2H2
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Solution
3) 22.2 g of C2H2
STEP 1 Given: 75.0 g of CO2
Need: mass (g) of C2H2
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Solution (continued)
STEP 3 Write conversion factors (continued):
4 moles of CO2 = 2 moles of C2H2
1. 14.6 g of H2O
2. 58.4 g of H2O
3. 117 g of H2O
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Solution
2) 58.4 g H2O
STEP 1 Given: 38.5 g of C3H8
Need: mass (g) of H2O
STEP 2 Write a plan to calculate grams of H2 O:
g of C3H8 moles of moles of g of H2O
C3H8 H2O
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Solution (continued)
STEP 3 Write conversion factors (continued):
1 mole of C3H8 = 44.1 g of C3H8
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Percent Yield and Limiting Reactants
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Theoretical, Actual, and Percent Yield
Theoretical yield:
▪ the maximum amount of product, which is calculated
using the balanced equation.
Actual yield:
▪ the amount of product obtained when the reaction
takes place
Percent yield:
▪ the ratio of actual yield to theoretical yield
Percent yield = actual yield (g) x 100
theoretical yield (g)
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Guide to Calculations for
Percent Yield
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Calculating Percent Yield
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Learning Check
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Solution
3) 76.2% yield
STEP 1 Given: 40.0 g of CO produced (actual)
30.0 g of O2 used
Need: percent yield of CO
STEP 2 Write a plan to calculate % yield of CO:
g of O2 moles of moles of g of CO
O2 CO (theoretical)
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Solution (continued)
STEP 3 Write conversion factors:
1 mole of O2 = 32.0 g of O2
1 mole O2 and 32.0 g O2
32.0 g O2 1 mole O2
1 mole of O2 = 2 moles of CO
1 mole O2 and 2 moles CO
2 moles CO 1 mole O2
1 mole of CO = 28.0 g of CO
1 mole CO and 28.0 g CO
28.0 g CO 1 mole CO
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Solution (continued)
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Learning Check
1) 31.3% of NH3
2) 56.9% of NH3
3) 80.0% of NH3
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Solution
2) 56.9%
STEP 1 Given: 16.0 g of NH3 produced (actual)
5.00 g of H2 used
Need: percent yield of NH3
STEP 2 Write a plan to calculate % yield of NH3:
g of H2 moles of moles of g of NH3
H2 NH3 (theoretical)
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Solution (continued)
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Limiting Reactant
▪ is used up
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Reacting Amounts
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Reacting Amounts (continued)
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Example 2 of an Everyday Limiting Reactant
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Limiting Reagent in chemical reaction
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Limiting Reagent
• In some cases, one of the reactants is usually used up
before the one.
• This means that there is a limiting reagent involved.
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Limiting Reagent
• How to determine the limiting reagent.
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Limiting Reagent
• Example 1:
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Limiting Reagent
Example 1:
Equation: 2 Fe + 3 S → Fe2S3
2 mol Fe, reacts with 3 mol S OR
2(56) g = 112 g of Fe, reacts with 3(32) = 96 g of S
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Limiting Reagent
• Example 2:
• Suppose that 1.00 g of sodium and 1.00 g of chlorine react to form
sodium chloride (NaCl). Which of these is limiting.
• Equation: 2 Na + Cl2 → 2 NaCl
• Moles of Na: nNa = 1.00 g × (1 mol Na / 23.0 g Na) = 0.0435 mol Na
• Moles of Cl: nCl2 = 1.00 g × (1 mol / 70.9 g Cl2) = 0.0141 mol Cl2
• If we normalise the no. of moles:
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153
Hydrated Compounds
• If ionic compounds are prepared in water solution and then isolated
as solids, the crystals often have molecules of water trapped in the
lattice.
• Compounds in which molecules of water are associated with the ions
of the compound are called hydrated compounds.
K2Cr2O7 CoCl2.6H2O
NiCl2.6H2O
CuSO4.5H2O NaCl
154
Hydrated Compounds
• Example:
• In the laboratory, you weigh out 1.023 g of hydrated
copper(II)sulphate, CuSO4 . xH2O (blue). After heating in
a porcelain crucible you are left with 0.654 g of anhydrous
copper(II)sulphate, CuSO4 (white). What is the value of x
in CuSO4 . xH2O ?
155
Hydrated Compounds
• You want to know how many moles of H2O is associated with each
mole of CuSO4; the ratio!
• Simply convert the masses you have to moles!
156
Hydrated Compounds
1 mol H 2 O
0.369 g H 2 O = 2.05 x 10-2 mol H2O
18.05 g H 2 O
1 mol CuSO 4
0.654 g H 2 O = 4.10 x 10-3 mol CuSO4
159.6 g CuSO 4
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Ions in Aqueous Solution
• Strong electrolyte:
✓ NaCl(aq) → Na+(aq) + Cl-(aq) : dissociation
✓ HCl(aq) + H2O(l) → H3O+(aq) + Cl-(aq) : ionisation
• Weak electrolyte:
✓ NH3(aq) + H2O(l) → NH4+(aq) + OH-(aq)
160
Molecular and Ionic Equations
162
Molecular and Ionic Equations
Molecular equation:
Ionic equation:
163
Molecular and Ionic Equations
• Example:
• Aqueous solutions of silver nitrate and sodium sulphate
are mixed. Write the net ionic reaction.
• Step 1:
✓ 2AgNO3(aq) + Na2SO4(aq) → 2 NaNO3(?) + Ag2SO4(?)
164
Molecular and Ionic Equations
165
Learning Check
• Use the rule “all metal halide salts are soluble, except those of Ag
and Pb” to answer the following questions:
✓ Complete and balance the metathesis reaction (include the
phase labels):
MgCℓ2(aq) + AgNO3(aq) →
• Complete the ionic and net ionic equations to show how the
precipitate was formed in the reaction shown above.
• What collective name is given to those ions that do not appear in the
net ionic equation?
166
Learning Check
• Balanced reaction:
✓ MgCℓ2(aq) + 2 AgNO3(aq) → Mg(NO3)2(aq) + 2 AgCl(s)
• Spectator ions
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References
• http://davis.k12.ut.us
• http://faculty.sgsc.edu/
• http://chem_lecture_Richmond-Hall.edu
• http://www.Cabrillo.edu/
• http://www.teachnlearnchem.com
• Spies, A. (2015). ECP1 Lecture. [CPUT]
• Adonis, S. (2016). ECP1 Lecture. [CPUT]
• Kotz, J.C., Treichel, P.M. and Townsend, J.R. (2012).
Chemistry & Chemical Reactivity. 8th Edition.
Brookes/Cole, Cengage Learning. China.
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