CE 0115 - 02 - Basic Concepts and Calculations in Chemistry
CE 0115 - 02 - Basic Concepts and Calculations in Chemistry
Basic Concepts
and Calculations
in Chemistry
CE 0115 (Chemistry for Engineers – Lecture Series)
Course Outcomes
At the end of this module, the student shall be able to:
1. Explain the chemical principles and concepts of structures and
bonding of common materials
Learning Outcomes
At the end of this module, the student shall be able to:
1. Describe the structure of atoms, molecules and ions based on
existing theories
2. Apply periodic trends in describing properties of an element and
chemical reactions
3. Describe different types of chemical bonds on how it affects the
molecular structure
Learning Outcomes
At the end of this module, the student shall be able to:
4. Perform basic stoichiometric calculations including limiting and
excess reactant and theoretical yield.
atom
element
Atom: Structure
Dalton’s Atomic Theory
2. All atoms of a given element are identical, having same size, mass
and chemical properties. The atoms of one element are different from
atoms of other elements.
Atom: Structure
Dalton’s Atomic Theory
3. In an ordinary chemical reaction, atoms move from one substance to
another, but no atom of any element disappears or is changed into an
atom of another element [Law of Conservation of Mass].
Atom: Structure
Dalton’s Atomic Theory
4. Compounds are formed when atoms of two or more elements
combine.
𝑶 𝟐
=
𝑪 𝟏
CO2
𝑶 𝟏
=
𝑪 𝟏
CO
Atom: Subatomic Particles
❑ The Dalton’s atomic theory was extended into a series of research
that led to the discovery of three subatomic particles:
ELECTRON
ATOMS PROTON
NEUTRON
Quantitative Properties of an Atom
1. Atomic Number (Z)
❑ The number of protons in the nucleus of each atom of an element.
❑ In a neutral atom the number of protons is equal to the number of
electrons, so the atomic number also indicates the number of
electrons present in the atom.
❑ The chemical identity of an atom can be determined solely from its
atomic number.
Quantitative Properties of an Atom
2. Mass Number (A)
❑ The total number of neutrons and protons present in the nucleus of
an atom of an element.
Example:
Molecules
Molecules
❑ A molecule is an aggregate of at least two atoms in a definite
arrangement held together by chemical forces (or chemical bonds ).
❑ Diatomic Molecules – molecules that contain two atoms.
❑ Polyatomic Molecules – molecules that contain more than two
atoms.
Ions
Ions
❑ An ion is an atom or a group of atoms that has a net positive or
negative charge.
❑ Cation – ions that contain net positive charge.
❑ Anion – ions that contain net negative charge.
Ions
Ions
❑ Monatomic Ions – ions that contain only one atom.
❑ Polyatomic Ions – ions that contain more one atom.
The Periodic Table
The Periodic Table
❑ Other groups with specific names are the pnictogens (group 15),
chalcogens (group 16), halogens (group 17), and the noble gases
(group 18, also known as inert gases).
The Periodic Table
❑ The elements can also be classified into the main-group elements
(or representative elements) in the columns labeled 1, 2, and 13–
18;
❑ The transition metals in the columns labeled 3–12; and
❑ The inner transition metals in the two rows at the bottom of the
table
❑ (the top-row elements are called lanthanides and the bottom-row
elements are actinides.
The Periodic Table
❑ Negative ion is always larger and positive ion is always smaller than
its parent element.
SUMMARY:
Reactivity
❑ Metal reactivity decreases from left to right across periods and
increases down groups whereas nonmetallic reactivity increases
from left to right and decreases down groups.
The Periodic Trends
Ionization Energy
Chemical Bonding
Chemical Bonding
❑ All chemical bonds share two characteristics. First, all bonds involve
exchange or sharing of electrons. Second, this exchange or
sharing of electrons results in lower energy for the compound
relative to the separate atoms.
❑ A chemical bond will not form, or will have only a fleeting
existence, unless it lowers the overall energy of the collection of
atoms involved.
The Chemical Bonding and Molecular Structure
Ionic Bonding
Ionic Bonding
Ionic Bonding
Metallic Bonding
Metallic Bonding
The Chemical Bonding and Molecular Structure
Metallic Bonding
Metallic Bonding
Covalent Bonding
Covalent Bonding
Covalent Bonding
Stoichiometry
Amount of Substance
❑ The mole (mol) is the amount of a substance that contains as many
elementary entities (atoms, molecules, or other particles) as there are atoms in
exactly 12 g (or 0.012 kg) of the carbon-12 isotope.
❑ Avogadro’s Number (NA) – it represents the number of atoms of an element
in a sample whose mass in grams is numerically equal to the atomic mass of
the element.
❑ The relationship molar mass of a substance and the amount of substance can
be written as:
𝒎𝒔𝒖𝒃𝒔𝒕𝒂𝒏𝒄𝒆
𝑴𝑴𝒔𝒖𝒃𝒔𝒕𝒂𝒏𝒄𝒆 =
𝒏𝒔𝒖𝒃𝒔𝒕𝒂𝒏𝒄𝒆
Amount of Substance
Molecular Mass (MM)
❑ The molecular mass (MM) is the mass (in grams or kilograms) of 1 mole of
units (such as molecules) of a substance.
m/MM
n(MM)
Sample Problem:
3. Aspirin is a compound with the molecular formula 𝐶9 𝐻8 𝑂4 . What is
its percent composition?
Chemical Reactions and Chemical Equations
Chemical Equations
❑ Chemical equations are designed to represent the transformation
of one or more chemical species into new substances.
❑ The original materials are called the reactants and they appear on
the left-hand side of the equation. The compounds that are formed
from the reaction are called products and appear on the right-
hand side of the equation.
Chemical Reactions and Chemical Equations
Chemical Equations
❑ An arrow is used to represent the changes that occur during the
reaction. Thus we can write a completely generic chemical
equation:
𝑅𝑒𝑎𝑐𝑡𝑎𝑛𝑡𝑠 → 𝑃𝑟𝑜𝑑𝑢𝑐𝑡𝑠
Chemical Equations
❑ We use chemical formulas to identify the specific reactants and
products. The physical states of the compounds are often
designated; (s) indicates a solid, (l) a liquid, (g) a gas, and (aq) a
substance dissolved in water.
Chemical Equations
❑ In the formation of water in the gas phase from the reaction of
gaseous hydrogen and oxygen gas, all substances involved in this
equation are gases, as indicated by the “(g)” notation. One
characteristic of this reaction is that it will only occur at high
temperatures.
❑ To show this, we placed the symbol ∆ or “delta” to denote the use
of heat in the reaction.
Chemical Reactions and Chemical Equations
Chemical Equations
∆
2𝐻2 𝑔 + 𝑂2 𝑔 →2𝐻2 𝑂(𝑔)
Chemical Reactions and Chemical Equations
Chemical Equations
ℎ𝑣
𝐻2 𝑔 + 𝐶𝑙2 𝑔 2𝐻𝐶𝑙(𝑔)
Chemical Reactions and Chemical Equations
Sample Problems:
1. Propane, 𝐶3 𝐻8 , is used as a fuel in many applications, including gas
barbecue grills. Because of its widespread use, extensive research is
underway to develop ways to produce propane from biomass. When
propane burns, it combines with oxygen, 𝑂2 , to form carbon dioxide
and water. Write a balanced chemical equation describing this
reaction.
Chemical Reactions and Chemical Equations
Sample Problems:
2. Balance the following chemical reactions.
Stoichiometry
Sample Problem:
1. In the combustion of methane, how many moles of 𝑂2 are required
if 6.75 mol of 𝐶𝐻4 is to be completely consumed?
Stoichiometry
Sample Problem:
2. Tetraphosphorus trisulfide, 𝑃4 𝑆3 , is used in the manufacture of
“strike anywhere” matches. Elemental phosphorus and sulfur react
directly to form 𝑃4 𝑆3 :
𝑃4 + 𝑆8 → 𝑃4 𝑆3
❑ The actual yield is the actual amount of product that is made. The
actual yield may never exceed the theoretical yield.
𝑎𝑐𝑡𝑢𝑎𝑙 𝑦𝑖𝑒𝑙𝑑
𝑝𝑒𝑟𝑐𝑒𝑛𝑡 𝑦𝑖𝑒𝑙𝑑 = 𝑥 100%
𝑡ℎ𝑒𝑜𝑟𝑒𝑡𝑖𝑐𝑎𝑙 𝑦𝑖𝑒𝑙𝑑
Stoichiometry
Sample Problem:
1. MTBE (methyl tert-butyl ether) has been used as an additive in
gasoline. The compound is produced by reacting methanol and
isobutene, according to the following equation:
Solids:
Solids:
❑ Each unit cell has six sides, and each side is a parallelogram. We
focus primarily on the cubic unit cells, in which all sides have the
same length and all angles are 90°, but the concepts that we
introduce also apply to substances whose unit cells are not cubic.
Solids, Liquids, and Solutions
Solids, Liquids, and Solutions
❑ For all unit cells except hexagonal, atoms on the faces contribute
½ atom to each unit cell, atoms on the edges contribute ¼ atom
to each unit cell, and atoms on the corners contribute 1/8 atom to
each unit cell.
Example
Metallic gold has a face-centered cubic unit cell. How many Au atoms
are in each unit cell?
Solids, Liquids, and Solutions
Solution
A face-centered cubic unit cell has eight atoms at the corners of the
cube and six atoms on the faces. Because atoms on a face are shared
by two unit cells, each counts as ½ atom per unit cell, giving 6 x ½ =
3 Au atoms per unit cell.
Atoms on a corner are shared by eight unit cells and hence contribute
only 1/8 atom per unit cell, giving 8 x 1/8 = 1 Au atom per unit cell.
The total number of Au atoms in each unit cell is thus 3 + 1 = 4.
Solids, Liquids, and Solutions
𝑚𝑜𝑙𝑒𝑠 𝑜𝑓 𝑠𝑜𝑙𝑢𝑡𝑒 𝑛
𝑀𝑜𝑙𝑎𝑟𝑖𝑡𝑦 𝑀 = =
𝑙𝑖𝑡𝑒𝑟𝑠 𝑜𝑓 𝑠𝑜𝑙𝑢𝑡𝑖𝑜𝑛 𝑉
Solids, Liquids, and Solutions
Example
𝑀𝑖 𝑉𝑖 = 𝑀𝑓 𝑉𝑓
Solids, Liquids, and Solutions
Example
𝑷𝑽 = 𝒏𝑹𝑻
Gases
𝑃𝑉
❑ The term is called the compression factor and is a measure of
𝑛𝑅𝑇
the ideality of a certain gas.
❑ An ideal gas will always equal 1 when plugged into this equation.
The greater it deviates from the number 1, the more it will behave
like a real gas rather than an ideal.
Gases
Volume V L, 𝑚3
Moles N mol
Temperature T K
Gases
Gas Constant (R):
𝐿 − 𝑎𝑡𝑚
0.08206
𝑚𝑜𝑙 − 𝐾
𝐽
8.314
𝑚𝑜𝑙 − 𝐾
𝐵𝑡𝑢
1.987
𝑙𝑏𝑚𝑜𝑙 − °𝑅
Gases
❑ Boyle’s Law describes the inverse proportional relationship
between pressure and volume at a constant temperature and a
fixed amount of gas. This law came from a manipulation of the
Ideal Gas Law.
1
𝑃∝
𝑉
𝑃1 𝑉1 = 𝑃2 𝑉2
Gases
❑ Charles's Law describes the directly proportional relationship
between the volume and temperature (in Kelvin) of a fixed amount
of gas, when the pressure is held constant.
𝑉∝𝑇
𝑉1 𝑉2
=
𝑇1 𝑇2
Gases
❑ Avogadro's Law states that the volume of a gas is directly
proportional to the amount of gas at a constant temperature and
pressure.
𝑉∝𝑛
𝑉1 𝑉2
=
𝑛1 𝑛2
Gases
❑ Amontons’ Law or Gay-Lussac’s Law states that the given a
constant number of mole of a gas and an unchanged volume,
pressure is directly proportional to temperature.
𝑃∝𝑇
𝑃1 𝑃2
=
𝑇1 𝑇2
Gases
❑ Combined Gas Law is an amalgamation of the three previously
known laws which are - Boyle's law PV = K, Charles law V/T = K,
and Gay-Lussac's law P/T = K.
𝑃1 𝑉1 𝑃2 𝑉2
=
𝑇1 𝑇2
Gases
❑ Standard Temperature and Pressure (STP) refers to the nominal
conditions in the atmosphere at sea level. These conditions are 0
degrees Celsius and 1 atmosphere (atm) of pressure.
At STP:
𝑃 = 1 𝑎𝑡𝑚
𝑇 = 0 ℃ 𝑜𝑟 273.15 𝐾
At SATP:
𝑃 = 1 𝑏𝑎𝑟 = 100 𝑘𝑃𝑎
𝑇 = 25 ℃ 𝑜𝑟 298.15 𝐾
A balloon is filled with helium, and its volume is 2.2 L at 298 K. The
balloon is then dunked into a thermos bottle containing liquid
nitrogen. When the helium in the balloon has cooled to the
temperature of the liquid nitrogen (77 K), what will the volume of the
balloon be?
Gases
Example
Thank you!
God bless on your studies.