Section 1.0

The Origin of Elements

From the Big Bang to the formation of atoms - the cosmic journey of matter

Key Concept

This chapter lays the foundations for explaining trends in physical and chemical properties of all inorganic compounds. To understand molecules and solids, we must first understand atoms.

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The Big Bang

About 14 billion years ago, the visible universe was concentrated into a point-like region that exploded. With initial temperatures of ~10⁹ K, fundamental particles had too much kinetic energy to bind together.

As the universe cooled and expanded, particles began adhering under various forces, eventually forming nuclei and atoms.

⏱️
Early Universe Composition

About two hours after the Big Bang, most matter existed as:

H 89%
He 11%
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Strong Force

A short-range but powerful attractive force between nucleons (protons and neutrons) that binds particles together into nuclei.

Electromagnetic Force

A relatively weak but long-range force between electric charges that binds electrons to nuclei to form atoms.

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Subatomic Particles
Particle Symbol Mass/mᵤ Mass Number Charge/e Spin
Electron e⁻ 5.486×10⁻⁴ 0 −1 ½
Proton p 1.0073 1 +1 ½
Neutron n 1.0087 1 0 ½
Photon γ 0 0 0 1
Positron e⁺ 5.486×10⁻⁴ 0 +1 ½

* mᵤ = 1.6605 × 10⁻²⁷ kg (atomic mass constant), e = 1.602 × 10⁻¹⁹ C (elementary charge)

Atomic Number (Z)

The number of protons in the nucleus of an atom.

Mass Number (A)

Total number of protons and neutrons (nucleon number).

Isotopes

Atoms with same Z but different mass numbers.

Section 1.1

Spectroscopic Information

How light reveals the secrets of atomic structure

Key Point

Spectroscopic observations on hydrogen atoms suggest that an electron can occupy only certain energy levels and that the emission of discrete frequencies of electromagnetic radiation occurs when an electron makes a transition between these levels.

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Hydrogen Emission Spectrum

When electromagnetic radiation from hydrogen is passed through a prism, it separates into distinct series:

UV (Lyman) Visible (Balmer) IR (Paschen, Brackett)
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The Rydberg Equation

Johann Rydberg found that all wavelengths in hydrogen's spectrum can be described by:

1/λ = R (1/n₁² − 1/n₂²)
Equation 1.1

Variables:

  • R = Rydberg constant = 1.097 × 10⁷ m⁻¹
  • n₁ = lower energy level (1, 2, 3, ...)
  • n₂ = higher energy level (n₁+1, n₁+2, ...)
  • λ = wavelength of emitted light

Spectral Series:

  • Lyman (n₁=1): Ultraviolet
  • Balmer (n₁=2): Visible
  • Paschen (n₁=3): Infrared
  • Brackett (n₁=4): Infrared
📊
Energy Level Diagram

The allowed energies of a hydrogenic atom are given by:

Eₙ = −hcRZ²/n²
where hcR = 13.6 eV = 1312 kJ mol⁻¹
0 eV
n = ∞ (ionization)
−0.54 eV
n = 5
−0.85 eV
n = 4 (N shell)
−1.51 eV
n = 3 (M shell): 3s, 3p, 3d
−3.4 eV
n = 2 (L shell): 2s, 2p
−13.6 eV
n = 1 (K shell): 1s
Section 1.2

Principles of Quantum Mechanics

The revolutionary theory that describes electron behavior in atoms

Key Point

Electrons can behave as particles or as waves. Solution of the Schrödinger equation gives wavefunctions (ψ), which describe the location and properties of electrons. The probability of finding an electron is proportional to ψ².

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Wave-Particle Duality

In 1924, Louis de Broglie suggested that electrons, like photons, exhibit both wave and particle properties.

λ = h/mv
de Broglie wavelength

This dual nature means we cannot know both position and momentum simultaneously.

🎯
Heisenberg's Uncertainty Principle

The product of uncertainty in momentum and position cannot be less than a fundamental limit:

Δp·Δx ≥ ½ℏ
where ℏ = h/2π

This is a fundamental property of nature, not a limitation of measurement.

📝
The Schrödinger Equation

Erwin Schrödinger formulated an equation that accounts for wave-particle duality:

−(ℏ²/2mₑ)(d²ψ/dx²) + V(x)ψ(x) = Eψ(x)
One-dimensional Schrödinger equation
−(ℏ²/2mₑ)(d²ψ/dx²)
Kinetic Energy
V(x)ψ(x)
Potential Energy
Eψ(x)
Total Energy
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Born Interpretation

The wavefunction ψ contains all information about an electron. The probability of finding an electron at a location is proportional to ψ².

  • High ψ² → high probability
  • ψ² = 0 → node (electron not found)
  • ψ² is the probability density
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Quantization

Physically acceptable solutions to the Schrödinger equation exist only for certain values of E.

This naturally explains why electrons can only possess discrete (quantized) energies in atoms.

〰️
Wavefunction Interference

✓ Constructive Interference

When wavefunctions have the same sign, they add to give enhanced amplitude.

(+) + (+) = (++)

✗ Destructive Interference

When wavefunctions have opposite signs, they cancel to give reduced amplitude.

(+) + (−) = (~0)
Section 1.3

Atomic Orbitals

The three-dimensional regions where electrons are most likely to be found

Key Point

Each orbital is uniquely labeled by three quantum numbers: n (principal), l (orbital angular momentum), and mₗ (magnetic). The wavefunction of an electron in an atom is called an atomic orbital.

n
Principal Quantum Number
n = 1, 2, 3, ...

Specifies energy & size

l
Angular Momentum
l = 0, 1, ..., n−1

Specifies shape

mₗ
Magnetic Quantum Number
mₗ = +l, ..., 0, ..., −l

Specifies orientation

mₛ
Spin Magnetic Number
mₛ = +½ or −½

Spin up ↑ or down ↓

🏷️
Subshell Designations
Value of l 0 1 2 3 4
Subshell s p d f g
Number of orbitals (2l+1) 1 3 5 7 9
Max electrons 2 6 10 14 18
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Orbital Shapes (Boundary Surfaces)

The boundary surface defines the region with ~90% probability of finding the electron.

s orbital
l = 0, spherical
p orbital
l = 1, dumbbell
d orbital
l = 2, cloverleaf
Nodes

Nodes are regions where the wavefunction passes through zero (ψ = 0). An electron will not be found at a node.

Radial Nodes

Spherical surfaces where R(r) = 0

Number = n − l − 1

Angular Nodes (Nodal Planes)

Planes through nucleus where Y(θ,φ) = 0

Number = l
Orbital n l Radial Nodes Angular Nodes Total Nodes
1s10000
2s20101
2p21011
3s30202
3p31112
3d32022
Section 1.4

Many-Electron Atoms

Penetration, shielding, and effective nuclear charge

Key Point

For atoms with more than one electron, we use the orbital approximation: each electron occupies an atomic orbital resembling those in hydrogenic atoms. Due to penetration and shielding, the order of energy levels becomes s < p < d < f.

🛡️
Shielding

The reduction of nuclear charge experienced by an electron due to repulsion from other electrons.

Zeff = Z − σ
Effective nuclear charge

σ is the shielding constant, determined empirically (Slater's rules).

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Penetration

The potential for an electron to be found inside shells of other electrons, experiencing more nuclear charge.

s orbitals penetrate most effectively (nonzero at nucleus). p, d, f orbitals have nodes at the nucleus.

Effective Nuclear Charge (Zeff) Across Period 2
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Energy Order in Many-Electron Atoms

Due to penetration and shielding effects:

ns < np < nd < nf

s orbitals are most penetrating, f orbitals are least penetrating

Section 1.5

The Building-Up Principle

Aufbau, Pauli Exclusion, and Hund's Rule

Pauli Exclusion Principle

No more than two electrons may occupy a single orbital and, if two do occupy a single orbital, then their spins must be paired (↑↓).

Equivalently: No two electrons can have the same four quantum numbers (n, l, mₗ, mₛ).

Hund's Rule

When more than one orbital has the same energy (degenerate), electrons occupy separate orbitals with parallel spins (↑↑).

✓ Correct (Carbon 2p²)

2p

✗ Incorrect

↑↓
2p
Aufbau (Building-Up) Principle

Orbitals are filled in order of increasing energy:

1s 2s 2p 3s 3p 4s 3d 4p 5s → ...
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Example Electron Configurations
H
Z = 1
1s1
C
Z = 6
[He] 2s2 2p2
Ne
Z = 10
[He] 2s2 2p6
Fe
Z = 26
[Ar] 3d6 4s2
Cr
Exception!
[Ar] 3d5 4s1
Cu
Exception!
[Ar] 3d10 4s1

⚠️ Exceptions occur to maximize exchange energy with half-filled (d⁵) or filled (d¹⁰) subshells.

Section 1.6

Classification of Elements

The periodic table reflects electronic structure

Key Point

The layout of the periodic table reflects the electronic structure of atoms. A block indicates the type of subshell being filled. The period number equals the principal quantum number n of the valence shell.

s-Block (Groups 1-2)

Last electron enters an s orbital. Includes alkali metals and alkaline earth metals.

Valence electrons = Group number

p-Block (Groups 13-18)

Last electron enters a p orbital. Includes metalloids, nonmetals, halogens, noble gases.

Valence electrons = Group − 10

d-Block (Groups 3-12)

Transition metals where (n−1)d orbitals are being filled.

Valence shell: ns + (n−1)d

f-Block

Lanthanoids and actinoids where (n−2)f orbitals are being filled.

Shown separately below the main table.

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Periodic Table (First 20 Elements)
s-block
p-block
Noble gases
Section 1.7

Atomic Properties

Periodic trends in radii, ionization energy, electron affinity, and electronegativity

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Atomic & Ionic Radii
Metallic Radius

Half the distance between centers of neighboring atoms in a metal.

Covalent Radius

Half the internuclear distance in a molecule.

Ionic Radius

Related to cation-anion distance in ionic compounds.

Down a group: Radii INCREASE
Higher n, more electron shells
Across a period: Radii DECREASE
Increasing Zeff
Lanthanoid Contraction

Elements after the f-block have smaller radii than expected because 4f orbitals have poor shielding. This makes 3rd row d-block elements similar in size to 2nd row (e.g., Mo ≈ W).

First Ionization Energy vs. Atomic Number
Ionization Energy

The minimum energy needed to remove an electron from a gas-phase atom:

A(g) → A⁺(g) + e⁻(g)
I = E(A⁺,g) − E(A,g)
Across a period: I INCREASES
Higher Zeff, electrons more tightly bound
Down a group: I DECREASES
Valence electrons farther from nucleus
Notable Exceptions:
  • B < Be: 2p electron is easier to remove than 2s
  • O < N: Electron pairing in O causes extra repulsion
🧲
Electron Affinity

The energy change when a gaseous atom gains an electron:

A(g) + e⁻(g) → A⁻(g)
Ea = E(A,g) − E(A⁻,g)

Positive Ea means A⁻ is more stable than A. Elements near F (especially halogens) have highest electron affinities.

Element Ea (kJ/mol) Notes
F328High due to small size
Cl349Highest!
O141
N−8Half-filled p subshell stable
Be≤0Filled 2s subshell
⚖️
Electronegativity (χ)

The power of an atom in a molecule to attract electrons to itself.

Pauling Scale (χP)

Based on bond energies

Mulliken Scale (χM)

χ = ½(I + Ea)

Allred-Rochow

Based on Zeff/r²

F
3.98
O
3.44
Cl
3.16
N
3.04
C
2.55
H
2.20

Electronegativity increases left → right and decreases top → bottom

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Polarizability

The ability of an atom to be distorted by an electric field. Related to size and electron configuration.

Fajan's Rules
  • Small, highly charged cations have polarizing ability
  • Large, highly charged anions are easily polarized
  • Cations without noble-gas configuration are easily polarized