In science, a formula is a concise way of expressing information symbolically, as in a mathematical formula or a chemical formula. The informal use of the term formula in science refers to the general construct of a relationship between given quantities.
In mathematics, a formula generally refers to an equation relating one mathematical expression to another, with the most important ones being mathematical theorems. For example, determining the volume of a sphere requires a significant amount of integral calculus or its geometrical analogue, the method of exhaustion.[3] However, having done this once in terms of some parameter (the radius for example), mathematicians have produced a formula to describe the volume of a sphere in terms of its radius:
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Having obtained this result, the volume of any sphere can be computed as long as its radius is known. Here, notice that the volume V and the radius r are expressed as single letters instead of words or phrases. This convention, while less important in a relatively simple formula, means that mathematicians can more quickly manipulate formulas which are larger and more complex.[4] Mathematical formulas are often algebraic, analytical or in closed form.[5]
In a general context, formulas often represent mathematical models of real world phenomena, and as such can be used to provide solutions (or approximate solutions) to real world problems, with some being more general than others. For example, the formula
is an expression of Newton's second law, and is applicable to a wide range of physical situations. Other formulas, such as the use of the equation of a sine curve to model the movement of the tides in a bay, may be created to solve a particular problem. In all cases, however, formulas form the basis for calculations.
In mathematical logic, a formula (often referred to as a well-formed formula) is an entity constructed using the symbols and formation rules of a given logical language.[7] For example, in first-order logic,
When the chemical compound of the formula consists of simple molecules, chemical formulas often employ ways to suggest the structure of the molecule. There are several types of these formulas, including molecular formulas and condensed formulas. A molecular formula enumerates the number of atoms to reflect those in the molecule, so that the molecular formula for glucose is C6H12O6 rather than the glucose empirical formula, which is CH2O. Except for the very simple substances, molecular chemical formulas generally lack needed structural information, and might even be ambiguous in occasions.
In computing, a formula typically describes a calculation, such as addition, to be performed on one or more variables. A formula is often implicitly provided in the form of a computer instruction such as.
Formulas used in science almost always require a choice of units.[11] Formulas are used to express relationships between various quantities, such as temperature, mass, or charge in physics; supply, profit, or demand in economics; or a wide range of other quantities in other disciplines.
An example of a formula used in science is Boltzmann's entropy formula. In statistical thermodynamics, it is a probability equation relating the entropy S of an ideal gas to the quantity W, which is the number of microstates corresponding to a given macrostate:
Since a chemical formula must be expressed as a single line of chemical element symbols, it often cannot be as informative as a true structural formula, which is a graphical representation of the spatial relationship between atoms in chemical compounds (see for example the figure for butane structural and chemical formulae, at right). For reasons of structural complexity, a single condensed chemical formula (or semi-structural formula) may correspond to different molecules, known as isomers. For example, glucose shares its molecular formula C6H12O6 with a number of other sugars, including fructose, galactose and mannose. Linear equivalent chemical names exist that can and do specify uniquely any complex structural formula (see chemical nomenclature), but such names must use many terms (words), rather than the simple element symbols, numbers, and simple typographical symbols that define a chemical formula.
Chemical formulae may be used in chemical equations to describe chemical reactions and other chemical transformations, such as the dissolving of ionic compounds into solution. While, as noted, chemical formulae do not have the full power of structural formulae to show chemical relationships between atoms, they are sufficient to keep track of numbers of atoms and numbers of electrical charges in chemical reactions, thus balancing chemical equations so that these equations can be used in chemical problems involving conservation of atoms, and conservation of electric charge.
A chemical formula identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element. In empirical formulae, these proportions begin with a key element and then assign numbers of atoms of the other elements in the compound, by ratios to the key element. For molecular compounds, these ratio numbers can all be expressed as whole numbers. For example, the empirical formula of ethanol may be written C2H6O because the molecules of ethanol all contain two carbon atoms, six hydrogen atoms, and one oxygen atom. Some types of ionic compounds, however, cannot be written with entirely whole-number empirical formulae. An example is boron carbide, whose formula of CBn is a variable non-whole number ratio with n ranging from over 4 to more than 6.5.
When the chemical compound of the formula consists of simple molecules, chemical formulae often employ ways to suggest the structure of the molecule. These types of formulae are variously known as molecular formulae and condensed formulae. A molecular formula enumerates the number of atoms to reflect those in the molecule, so that the molecular formula for glucose is C6H12O6 rather than the glucose empirical formula, which is CH2O. However, except for very simple substances, molecular chemical formulae lack needed structural information, and are ambiguous.
For simple molecules, a condensed (or semi-structural) formula is a type of chemical formula that may fully imply a correct structural formula. For example, ethanol may be represented by the condensed chemical formula CH3CH2OH, and dimethyl ether by the condensed formula CH3OCH3. These two molecules have the same empirical and molecular formulae (C2H6O), but may be differentiated by the condensed formulae shown, which are sufficient to represent the full structure of these simple organic compounds.
Chemical formulae as described here are distinct from the far more complex chemical systematic names that are used in various systems of chemical nomenclature. For example, one systematic name for glucose is (2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal. This name, interpreted by the rules behind it, fully specifies glucose's structural formula, but the name is not a chemical formula as usually understood, and uses terms and words not used in chemical formulae. Such names, unlike basic formulae, may be able to represent full structural formulae without graphs.
In chemistry, the empirical formula of a chemical is a simple expression of the relative number of each type of atom or ratio of the elements in the compound. Empirical formulae are the standard for ionic compounds, such as CaCl2, and for macromolecules, such as SiO2. An empirical formula makes no reference to isomerism, structure, or absolute number of atoms. The term empirical refers to the process of elemental analysis, a technique of analytical chemistry used to determine the relative percent composition of a pure chemical substance by element.
For example, hexane has a molecular formula of C6H14, and (for one of its isomers, n-hexane) a structural formula CH3CH2CH2CH2CH2CH3, implying that it has a chain structure of 6 carbon atoms, and 14 hydrogen atoms. However, the empirical formula for hexane is C3H7. Likewise the empirical formula for hydrogen peroxide, H2O2, is simply HO, expressing the 1:1 ratio of component elements. Formaldehyde and acetic acid have the same empirical formula, CH2O. This is also the molecular formula for formaldehyde, but acetic acid has double the number of atoms.
Like the other formula types detailed below, an empirical formula shows the number of elements in a molecule, and determines whether it is a binary compound, ternary compound, quaternary compound, or has even more elements.
Molecular formulae simply indicate the numbers of each type of atom in a molecule of a molecular substance. They are the same as empirical formulae for molecules that only have one atom of a particular type, but otherwise may have larger numbers. An example of the difference is the empirical formula for glucose, which is CH2O (ratio 1:2:1), while its molecular formula is C6H12O6 (number of atoms 6:12:6). For water, both formulae are H2O. A molecular formula provides more information about a molecule than its empirical formula, but is more difficult to establish.
In addition to indicating the number of atoms of each elementa molecule, a structural formula indicates how the atoms are organized, and shows (or implies) the chemical bonds between the atoms. There are multiple types of structural formulas focused on different aspects of the molecular structure.
The connectivity of a molecule often has a strong influence on its physical and chemical properties and behavior. Two molecules composed of the same numbers of the same types of atoms (i.e. a pair of isomers) might have completely different chemical and/or physical properties if the atoms are connected differently or in different positions. In such cases, a structural formula is useful, as it illustrates which atoms are bonded to which other ones. From the connectivity, it is often possible to deduce the approximate shape of the molecule. 152ee80cbc