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A chemical formula is a notation used by scientists to show the number and type of atoms
present in a molecule, using atomic symbols and numerical subscripts. A chemical formula is a
simple representation, in writing, of a three-dimensional molecule that exists. A chemical
formula describes a substance, down to the exact atoms which make it up. There are three
basic types of chemical formula, the empirical formula, the molecular formula, and the structural
formula.
Each one of these chemical formula provides slightly different information about the makeup of
a substance, and clues to its three-dimensional shape and how it will interact with other
molecules, atoms, and ions. In a chemical formula, the letters represent the atomic symbol of
each atom. The subscript (lower) represents the number of each atom, while the superscript
(higher) represents the charge on a given atom. A coefficient before a chemical formula
represents that many units of the molecule. Each of the different types of the chemical formula
is read a little differently.
Types of Chemical Formula
Empirical Formula
The empirical chemical formula represents the relative number of atoms of each element in the
compound. Some compounds, like water, have the same empirical and molecular formula
because they are small and have the same ratio of atoms in molecules and the number of
atoms in a molecule. The empirical and molecular formula for water looks like this:
H2O
The empirical formula is determined by the weight of each atom within the molecule. Therefore,
for a slightly bigger molecule like hydrogen peroxide, the empirical formula shows only the ratio
of atoms. In this case:
HO:
However, this empirical chemical formula only shows the basic foundation of the molecule. In
reality, two HO: molecules come together to form a hydrogen peroxide molecule.
Molecular Formula
The molecular formula comes in to show the actual number of atoms within each molecule.
Thus, for hydrogen peroxide the molecular formula is thus:
H2O2
As you can see, this somewhat confuses the actual structure of hydrogen peroxide. While the
empirical chemical formula gives clues that the molecule has two oxygen atoms bonded
together in the middle, the molecular formula does not make that clear at all. However, the
molecular formula is often used to describe molecules, simply because it is convenient and
most molecules can be looked up after their formula is identified.
Structural Formula
The structural formula of a molecule is a chemical formula with a more artistic twist. In these
chemical formulas, the actual bonds between molecules are shown. This helps the reader
understand how the different atoms are connected, and thus how the molecule functions in
space. There are many different structural chemical formulas to consider.
The simplest, the electron dot method, uses colons and periods to show bonds between atoms.
Each colon represents a pair of electrons, shared between the atoms on either side of the colon.
This formula more accurately represents the actual arrangement of atoms within a molecule. In
the case of water, the electron dot formula would look like this:
H:O:H
Another chemical formula, the bond-line formula, also shows the bonds between atoms. Instead
of showing each electron that is shared, a line is used to designate an electron pair shared
between the atoms. Water, in the bond-line formula, looks like this:
H-O-H
Scientists have come up with much more advanced formula and representations of molecules,
including three-dimensional ball-and-stick models, space-filling models, and even models which
consider the electron density of the atoms being modeled. These advanced models consider not
only the atoms present and their number, but the angles, sizes, and distances between atoms
within a molecule. The ball and stick model of water, below, even shows the polarity of the
molecule, as the large oxygen atom tends to attract the most electrons.
Molecular Mass from Chemical Formula
One important skill derived from the chemical formula is calculating the molecular mass. The
molecular mass of a molecule is the sum of all the different atoms within. Each substance has a
particular molecular mass, determined by its particular makeup.
To determine the molecular mass of a substance, consider the chemical formula. The formula
easily displays each atom present. Be sure to multiply by the number of atoms of each
molecule. The subscripts on each atom will indicate how many there are. Some large molecules
with multiple similar groups will show the groups something like the example below:
C(OH)4
In this case, there are four groups of (OH), not 4 hydrogen atoms. Make sure you take this into
account when calculating molecular mass. The molecular mass can be used to identify
substances, properly weigh substances for experiments, and do several calculations involving
the energy involved in chemical reactions. Scientists often use a chemical formula as a store of
much of this information, without having to explain basic chemistry in every paper.
3. Write and name compounds with polyatomic ions or oxyanions, hydrates, binary
acids, and oxyacids.
Many materials exist as simply binary compounds composed of a metal cation and a nonmetal
anion, with each ion consisting of only one type of atom. Other combinations of atoms also
exist, either larger ionic complexes or complete molecules. Some of the most useful materials
we work with contain polyatomic ions.
Polyatomic Ions
A polyatomic ion is an ion composed of more than one atom. The ammonium ion consists of
one nitrogen atom and four hydrogen atoms. Together, they comprise a single ion with
a 1+1+ charge and a formula of NH+4NH4+. The carbonate ion consists of one carbon atom
and three oxygen atoms and carries an overall charge of 2−2−. The formula of the carbonate
ion is CO2−3CO32−. The atoms of a polyatomic ion are tightly bonded together and so the
entire ion behaves as a single unit. The figures below show several models.
(left) The ammonium ion (NH+4)(NH4+) is a nitrogen atom (blue) bonded to four hydrogen
atoms (white). (middle) The hydroxide ion (OH−)(OH−) is an oxygen atom (red) bonded to a
hydrogen atom. (left): The carbonate ion (CO2−3)(CO32−) is a carbon atom (black) bonded to
three oxygen atoms.
The vast majority of polyatomic ions are anions, many of which end in -ate or -ite. Notice that in
some cases such as nitrate (NO−3)(NO3−) and nitrite (NO−2)(NO2−), multiple anions consist of
the same two elements. In these cases, the difference between the ions is in the number of
oxygen atoms present, while the overall charge is the same. As a class, these are called
oxoanions. When there are two oxoanions for a particular element, the one with the greater
number of oxygen atoms gets the -ate suffix, while the one with the fewer number of oxygen
atoms gets the -ite suffix. The four oxoanions of chlorine are shown below.
ClO−ClO−, hypochlorite
ClO−2ClO2−, chlorite
ClO−3ClO3−, chlorate
ClO−4ClO4−, perchlorate
In cases such as this, the ion with one more oxygen atom than the -ate anion is given a per-
prefix. The ion with one fewer oxygen atom than the -ite anion is given a hypo- prefix.
Oxyanions
Some elements can form more than one oxyanion (polyatomic
ions that contain oxygen), each containing a different number of
oxygen atoms. For example, chlorine can combine with oxygen in
four ways to form four different oxyanions: ClO4−, ClO3−, ClO2−,
and ClO−. (Note that in a family of oxyanions, the charge remains
the same; only the number of oxygen atoms varies.)
The most common of the chlorine oxyanions are chlorate, ClO3−.
You will generally find that the most common of an element’s
oxyanions has a name with the form (root)ate. These can be
memorized from See below. The names of the other possible
oxyanions are determined as follows (see below).
The anion with one more oxygen atom than the (root)ate anion is
named by putting per- at the beginning of the root and -ate at the
end. For example, ClO4− is perchlorate.
The anion with one fewer oxygen atom than the (root)ate anion is
named with -ite on the end of the root. ClO2− is chlorite.
The anion with two fewer oxygen atoms than the (root)ate anion is
named by putting hypo- at the beginning of the root and -ite at the
end. ClO− is hypochlorite.
EXAMPLE 1 - Naming Polyatomic Ions: Write names that
correspond to the following formulas for polyatomic ions:
(1) PO33- (with barium ions in glass)
(2) HSO4− (in perfumes).
SOLUTION:
1. PO33− is phosphite. PO43− is phosphate, and this ion has one
less oxygen.
2. HSO4- is hydrogen sulfate. This could be called by its
nonsystematic name, bisulfate, but it is preferable to use the
systematic name, which shows that one H+ ion has been added
to sulfate, SO42-.
Pictured are the Lewis structures, ball-and-stick models, and space-filling models for molecules
of methane, ethane, and pentane.
Alkenes
Organic compounds that contain one or more double or triple bonds between carbon atoms are
described as unsaturated. You have likely heard of unsaturated fats. These are complex organic
molecules with long chains of carbon atoms, which contain at least one double bond between
carbon atoms. Unsaturated hydrocarbon molecules that contain one or more double bonds are
called alkenes. Carbon atoms linked by a double bond are bound together by two bonds, one σ
bond, and one π bond. Double and triple bonds give rise to a different geometry around the
carbon atom that participates in them, leading to important differences in molecular shape and
properties. The differing geometries are responsible for the different properties of unsaturated
versus saturated fats.
Ethene, C2H4, is the simplest alkene. Each carbon atom in ethene, commonly called ethylene,
has a trigonal planar structure. The second member of the series is propene (propylene)
(Figure 22.2.622.2.6); the butene isomers follow in the series. Four carbon atoms in the chain of
butene allow for the formation of isomers based on the position of the double bond, as well as a
new form of isomerism.
Expanded structures, ball-and-stick structures, and space-filling models for the alkenes ethene,
propene, and 1-butene are shown.
Ethylene (the common industrial name for ethene) is a basic raw material in the production of
polyethylene and other important compounds. Over 135 million tons of ethylene were produced
worldwide in 2010 for use in the polymer, petrochemical, and plastic industries. Ethylene is
produced industrially in a process called cracking, in which the long hydrocarbon chains in a
petroleum mixture are broken into smaller molecules.
Alkynes
Hydrocarbon molecules with one or more triple bonds are called alkynes; they make up another
series of unsaturated hydrocarbons. Two carbon atoms joined by a triple bond are bound
together by one σ bond and two π bonds. The sp-hybridized carbons involved in the triple bond
have bond angles of 180°, giving these types of bonds a linear, rod-like shape.
The simplest member of the alkyne series is ethyne, C2H2, commonly called acetylene. The
Lewis structure for ethyne, a linear molecule, is:
The IUPAC nomenclature for alkynes is similar to that for alkenes except that the suffix -one is
used to indicate a triple bond in the chain. For example, CH3CH2C≡CHCH3CH2C≡CH is called
1-butyne.
Aromatic Hydrocarbons
Benzene, C6H6, is the simplest member of a large family of hydrocarbons, called aromatic
hydrocarbons. These compounds contain ring structures and exhibit bonding that must be
described using the resonance hybrid concept of valence bond theory or the delocalization
concept of molecular orbital theory. (To review these concepts, refer to the earlier chapters on
chemical bonding). The resonance structures for benzene, C6H6, are:
Valence bond theory describes the benzene molecule and other planar aromatic hydrocarbon
molecules as hexagonal rings of sp2-hybridized carbon atoms with the unhybridized p orbital of
each carbon atom perpendicular to the plane of the ring. Three valence electrons in
the sp2 hybrid orbitals of each carbon atom and the valence electron of each hydrogen atom
form the framework of σ bonds in the benzene molecule. The fourth valence electron of each
carbon atom is shared with an adjacent carbon atom in their unhybridized p orbitals to yield the
π bonds. Benzene does not, however, exhibit the characteristics typical of an alkene. Each of
the six bonds between its carbon atoms is equivalent and exhibits properties that are
intermediate between those of a C–C single bond and a C=CC=C double bond. To represent
this unique bonding, structural formulas for benzene and its derivatives are typically drawn with
single bonds between the carbon atoms and a circle within the ring as shown below.
5. Values Integration: promote cooperation, respect the ideas of others, and practice
awareness and responsibility.
Big Idea: Naming and Writing Formulas of Compounds.
* Importance of naming compounds, you say? That's quite something. To do away with
names. A colorless odorless compound formed by the reaction of two gases, one of
which burns and the other is a supporter of combustion. Got it? Of course, it's water! But
is it? What about hydrogen peroxide? Well! One could argue that we may add further
details to the earlier description to get a better fix on the name. But, then the descriptions
get bigger and bigger and become grossly impractical!
So, we need a name for a compound. Now, we could have named any compound any
fancy name and that's exactly what happened. People named compounds on their
source, uses, or simply on some property of the combining elements or the compound!
However, as the science of chemistry prospered, it became more and more cumbersome
to remember names, particularly in the field of organic chemistry. So, came the practice
of systematic naming! IUPAC recommends the rules for the systematic naming of
compounds. Though we feel comfortable with remembering compounds by their trivial
names, sometimes it is not possible to assign a simple trivial name to a very complicated
compound and this is where systematic naming finds its use.
Writing name and formula wrongly means it is not that element or compound. Zn is the
symbol of Zinc and Sn is the symbol of tin. Exchanging the letter Z with S changes the
story. Similarly, H2O is the formula for water and D20 is the formula for heavy water. So
be careful in learning, remembering, and reproducing chemical names and formulas.sss