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Compounds & Molecules
NaCl, salt
Buckyball, C60
Ethanol, C2H6O
Molecule: The smallest identifiable
unit that retains the physical and
chemical properties of the pure
substances.
Compounds & Molecules
• COMPOUND is a combination of 2 or
more elements in definite ratios by mass.
• The character of each element is lost when
forming a compound (e.g., think of NaCl).
• MOLECULES are the smallest units of a
compound that retains the characteristics of
the compound.
MOLECULAR FORMULAS
• Formula for glycine is C2H5NO2
(description of the composition)
• In one molecule there are
– 2 C atoms
– 5 H atoms
– 1 N atom
– 2 O atoms
CONDENSED FORMULAS
• Formula for glycine is NH2CH2CO2H
(composition and functional groups)
• In one molecule there are
– 1 NH2 (amine group)
– 1 CH2 group
– 1 CO2H group
STRUCTURAL FORMULAS
• Show how the atoms are attached within a
molecule
• The lines between atoms represent chemical
bonds that hold the atoms together.
WRITING FORMULAS
• Can also write glycine as the condensed formula
H2NCH2COOH
showing functional groups (atom ordering and
connectivity)
• or in the form of a structural formula
showing how atoms are attached to each other
(bond orders)
C
H
H C
H
H
O
O H
N
MOLECULAR MODELING
C
H
H C
H
H
O
O H
N
Ball & stick Space-filling
Drawing of glycine
An even higher level of structural detail
Resources for
Molecular Modeling
• Modeling software
–CAChe (General Chemistry Interactive
CD-ROM)
–Rasmol
–Molden
–Gaussview
–Maestro
MOLECULAR WEIGHT
AND MOLAR MASS
Molecular weight = sum of the
atomic weights of all atoms in the
molecule.
Molar mass = molecular weight in
grams per mol.
What is the molar
mass of ethanol,
C2H6O?
1 mol contains
2 moles of C (12.01 g C/1 mol) = 24.02 g C
6 moles of H (1.01 g H/1 mol) = 6.06 g H
1 mol of O (16.00 g O/1 mol) = 16.00 g O
TOTAL = molar mass = 46.08 g/mol
• Formula =
• Molar mass =
Tylenol
C8H9NO2
151.2 g/mol
Molar Mass
How many moles of alcohol (C2H6O)
are there in a “standard” can of beer
if there are 21.3 g of C2H6O?
(a) Molar mass of C2H6O = 46.08 g/mol
(b) Calc. moles of alcohol
21.3 g •
1 mol
46.08 g
= 0.462 mol
How many molecules of alcohol are
there in a “standard” can of beer if
there are 21.3 g of C2H6O?
= 2.78 x 1023 molecules
We know there are 0.462 mol of C2H6O.
0.462 mol •
6.022 x 1023 molecules
1 mol
How many atoms of C are there in
a “standard” can of beer if there are
21.3 g of C2H6O?
= 5.57 x 1023 C atoms
There are 2.78 x 1023 molecules.
Each molecule contains 2 C atoms.
Therefore, the number of C atoms is
2.78 x 1023 molecules •
2 C atoms
1 molecule
Molecular & Ionic Compounds
Heme
NaCl
Molecular compounds consist of discrete molecules
Ionic compounds consist of discrete ions
IONS AND IONIC COMPOUNDS
• IONS are atoms or groups of atoms with a positive
or negative charge.
• Taking away an electron from an atom gives a
CATION with a positive charge
• Adding an electron to an atom gives an ANION
with a negative charge.
Forming Cations & Anions
A CATION forms
when an atom
loses one or
more electrons.
An ANION forms
when an atom
gains one or
more electrons
Mg --> Mg2+ + 2 e- F + e- --> F-
oxidation reduction
oxidation
reduction
PREDICTING ION CHARGES
In general
• metals (Mg) lose electrons ---> cations
• nonmetals (F) gain electrons ---> anions
Charges on Common Ions
+3
-4 -1
-2
-3
+1
+2
By losing or gaining e-, atom has same number of
electrons as nearest Group 8A atom.
Cation charge=group #
Anion charge=group #-8
Predicting Charges on Monatomic Ions
METALS
M ---> n e- + Mn+
where n = periodic group
Na+ sodium ion
Mg2+ magnesium ion
Al3+ aluminum ion
Transition metals --> M2+ or M3+
are common
Fe2+ iron(II) ion
Fe3+ iron(III) ion
NONMETALS
NONMETAL + n e- ------> Xn-
where n = 8 - Group no.
C4-,carbide N3-, nitride O2-, oxide
S2-, sulfide
F-, fluoride
Cl-, chloride
Group 7A
Group 6A
Group 4A Group 5A
Br-, bromide
I-, iodide
Ion Formation
Reaction of
aluminum
and
bromine
POLYATOMIC IONS
CD Screen 3.6
Groups of atoms with a charge.
MEMORIZE the names and formulas of common
polyatomic ions listed in Table 3.1, page 107 (next slide)
molecules and compounds-structure and reactivity
Polyatomic Ions
NH4
+
ammonium ion
One of the few common
polyatomic cations
Polyatomic Ions
(oxoanions)
HNO3
nitric acid
NO3
-
nitrate ion
Prefix per- and suffix –ate: largest #
Suffix -ate : greater # of oxygen atoms
Suffix -ite : smaller # of oxygen atoms
Prefix hypo- and suffix –ite: smallest #
SO4
2-
sulfate ion
SO3
2-
sulfite ion
Polyatomic Ions
NO3
-
nitrate ion
NO2
-
nitrite ion
Polyatomic Ions
Polyatomic Ions
CO3
2-
carbonate ion
HCO3
-
bicarbonate ion
hydrogen carbonate
PO4
3-
phosphate ion
CH3CO2
-
acetate ion
Polyatomic Ions
CATION +
ANION --->
COMPOUND
A neutral compd.
requires
equal number of +
and - charges.
COMPOUNDS
FORMED
FROM IONS
Na+ + Cl- --> NaCl
IONIC COMPOUNDS
NH4
+
Cl-
ammonium chloride, NH4Cl
Some Ionic Compounds
Mg2+ + NO3
- ----> Mg(NO3)2
magnesium nitrate
Fe2+ + PO4
3- ----> Fe3(PO4)2
iron(II) phosphate
calcium fluoride
Ca2+ + 2 F- ---> CaF2
Properties of Ionic Compounds
Forming NaCl from Na and Cl2
• A metal atom can
transfer an
electron to a
nonmetal.
• The resulting
cation and anion
are attracted to
each other by
electrostatic
forces.
Electrostatic Forces
The oppositely charged ions in ionic compounds are
attracted to one another by ELECTROSTATIC
FORCES.
These forces are governed by COULOMB’S LAW.
Electrostatic Forces
COULOMB’S LAW
Force of attraction =
(charge on +)(charge on -)
(distance between ions)2
As ion charge increases, the attractive force
_______________.
As the distance between ions increases, the
attractive force ________________.
This idea is important and will come up
many times in future discussions!
Importance of Coulomb’s Law
NaCl, Na+ and Cl-,
m.p. 804 oC
MgO, Mg2+ and O2-
m.p. 2800 oC
ELEMENTS THAT EXIST AS
MOLECULES
See SCREEN 3.2
on the CD-ROM
Allotropes of C
Screen 3.2
ELEMENTS THAT EXIST AS
DIATOMIC MOLECULES (gases)
ELEMENTS THAT EXIST AS
POLYATOMIC MOLECULES
White P4 and polymeric
red phosphorus
S8 sulfur
molecules
Molecular Compounds
Compounds without Ions
CH4 methane
CO2 Carbon dioxide
BCl3 boron trichloride
Naming Molecular
Compounds
CH4 methane
BCl3
boron trichloride
CO2 Carbon dioxide
All are
formed from
two or more
nonmetals.
Ionic
compounds
generally
involve a metal
and nonmetal
(NaCl)
Empirical & Molecular
Formulas
A pure compound always consists of the
same elements combined in the same
proportions by weight.
Therefore, we can express molecular
composition as PERCENT BY
WEIGHT
Ethanol, C2H6O
52.13% C
13.15% H
34.72% O
Percent Composition
Consider some of the family of nitrogen-
oxygen compounds:
NO2, nitrogen dioxide and closely
related, NO, nitrogen monoxide (or
nitric oxide)
Structure of NO2
Chemistry of NO,
nitrogen monoxide
Percent Composition
Consider NO2, Molar mass = ?
What is the weight percent of N and of O?
Wt. % O  2 (16.0 g O per mole )
46.0 g
x 100%  69.6%
Wt. % N =
14.0 g N
46.0 g NO2
• 100% = 30.4 %
What are the weight percentages of N and O in NO?
Determining Formulas
In chemical analysis we determine
the % by weight of each element in a given
amount of pure compound and derive the
EMPIRICAL or SIMPLEST formula.
PROBLEM: A compound of B and H
is 81.10% B. What is its empirical
formula?
• Because it contains only B and H, it
must contain 18.90% H.
• In 100.0 g of the compound there are
81.10 g of B and 18.90 g of H.
• Calculate the number of moles of each
constitutent.
A compound of B and H is 81.10% B. What is
its empirical formula?
Calculate the number of moles of each
element in 100.0 g of sample.
81.10 g B •
1 mol
10.81 g
= 7.502 mol B
18.90 g H •
1 mol
1.008 g
= 18.75 mol H
A compound of B and H is 81.10% B. What is
its empirical formula?
Now, recognize that atoms combine in the
ratio of small whole numbers
Find the ratio of moles of elements in
the compound.
A compound of B and H is 81.10% B. What is
its empirical formula?
But we need a whole number ratio.
2.5 mol H/1.0 mol B = 5 mol H to 2 mol B
EMPIRICAL FORMULA = B2H5
Take the ratio of moles of B and H. Always
divide by the smaller number.
18.75 mol H
7.502 mol B
=
2.499 mol H
1.000 mol B
=
2.5 mol H
1.0 mol B
A compound of B and H is 81.10% B. What is
its empirical formula?
A compound of B and H is 81.10% B.
Its empirical formula is B2H5. What is
its molecular formula ?
Is the molecular formula B2H5, B4H10,
B6H15, B8H20, etc.?
B2H6 is one example of this class of compounds.
B2H6
A compound of B and H is 81.10% B. Its empirical
formula is B2H5. What is its molecular formula?
We need to do an EXPERIMENT to find
the MOLAR MASS.
Here experiment gives 53.3 g/mol
Compare with the mass of B2H5
= 26.66 g/unit
Find the ratio of these masses.
53.3 g/mol
26.66 g/unit of B2H5
=
2 units of B2H5
1 mol
Molecular formula = B4H10
How to Determine the molar mass?
Mass spectrometer
Mass Spectrum of Ethanol
Mass Spectrum of Ethanol
(from the NIST site)
46
45
CH3CH2OH+
CH3CH2O+
31
CH2O+
Determine the formula of a
compound of Sn and I using the
following data.
• Reaction of Sn and I2 is done using excess Sn.
• Mass of Sn in the beginning = 1.056 g
• Mass of iodine (I2) used = 1.947 g
• Mass of Sn remaining = 0.601 g
Find the mass of Sn that combined with
1.947 g I2.
Mass of Sn initially = 1.056 g
Mass of Sn recovered = 0.601 g
Mass of Sn used = 0.455 g
Find moles of Sn used:
0.455 g Sn •
1 mol
118.7 g
= 3.83 x 10-3 mol Sn
Tin and Iodine Compound
Tin and Iodine Compound
Now find the number of moles of I2 that
combined with 3.83 x 10-3 mol Sn. Mass
of I2 used was 1.947 g.
1.947 g I2 •
1 mol
253.81 g
= 7.671 x 10-3 mol I2
How many moles of iodine atoms?
= 1.534 x 10-2 mol I atoms
7.671 x 10-3 mol I2
2 mol I atoms
1 mol I2






Tin and Iodine Compound
Now find the ratio of number of moles of moles
of I and Sn that combined.
1.534 x 10-2 mol I
3.83 x 10-3 mol Sn
=
4.01 mol I
1.00 mol Sn
Empirical formula is SnI4

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molecules and compounds-structure and reactivity

  • 1. Compounds & Molecules NaCl, salt Buckyball, C60 Ethanol, C2H6O Molecule: The smallest identifiable unit that retains the physical and chemical properties of the pure substances.
  • 2. Compounds & Molecules • COMPOUND is a combination of 2 or more elements in definite ratios by mass. • The character of each element is lost when forming a compound (e.g., think of NaCl). • MOLECULES are the smallest units of a compound that retains the characteristics of the compound.
  • 3. MOLECULAR FORMULAS • Formula for glycine is C2H5NO2 (description of the composition) • In one molecule there are – 2 C atoms – 5 H atoms – 1 N atom – 2 O atoms
  • 4. CONDENSED FORMULAS • Formula for glycine is NH2CH2CO2H (composition and functional groups) • In one molecule there are – 1 NH2 (amine group) – 1 CH2 group – 1 CO2H group
  • 5. STRUCTURAL FORMULAS • Show how the atoms are attached within a molecule • The lines between atoms represent chemical bonds that hold the atoms together.
  • 6. WRITING FORMULAS • Can also write glycine as the condensed formula H2NCH2COOH showing functional groups (atom ordering and connectivity) • or in the form of a structural formula showing how atoms are attached to each other (bond orders) C H H C H H O O H N
  • 7. MOLECULAR MODELING C H H C H H O O H N Ball & stick Space-filling Drawing of glycine An even higher level of structural detail
  • 8. Resources for Molecular Modeling • Modeling software –CAChe (General Chemistry Interactive CD-ROM) –Rasmol –Molden –Gaussview –Maestro
  • 9. MOLECULAR WEIGHT AND MOLAR MASS Molecular weight = sum of the atomic weights of all atoms in the molecule. Molar mass = molecular weight in grams per mol.
  • 10. What is the molar mass of ethanol, C2H6O? 1 mol contains 2 moles of C (12.01 g C/1 mol) = 24.02 g C 6 moles of H (1.01 g H/1 mol) = 6.06 g H 1 mol of O (16.00 g O/1 mol) = 16.00 g O TOTAL = molar mass = 46.08 g/mol
  • 11. • Formula = • Molar mass = Tylenol C8H9NO2 151.2 g/mol
  • 13. How many moles of alcohol (C2H6O) are there in a “standard” can of beer if there are 21.3 g of C2H6O? (a) Molar mass of C2H6O = 46.08 g/mol (b) Calc. moles of alcohol 21.3 g • 1 mol 46.08 g = 0.462 mol
  • 14. How many molecules of alcohol are there in a “standard” can of beer if there are 21.3 g of C2H6O? = 2.78 x 1023 molecules We know there are 0.462 mol of C2H6O. 0.462 mol • 6.022 x 1023 molecules 1 mol
  • 15. How many atoms of C are there in a “standard” can of beer if there are 21.3 g of C2H6O? = 5.57 x 1023 C atoms There are 2.78 x 1023 molecules. Each molecule contains 2 C atoms. Therefore, the number of C atoms is 2.78 x 1023 molecules • 2 C atoms 1 molecule
  • 16. Molecular & Ionic Compounds Heme NaCl Molecular compounds consist of discrete molecules Ionic compounds consist of discrete ions
  • 17. IONS AND IONIC COMPOUNDS • IONS are atoms or groups of atoms with a positive or negative charge. • Taking away an electron from an atom gives a CATION with a positive charge • Adding an electron to an atom gives an ANION with a negative charge.
  • 18. Forming Cations & Anions A CATION forms when an atom loses one or more electrons. An ANION forms when an atom gains one or more electrons Mg --> Mg2+ + 2 e- F + e- --> F- oxidation reduction
  • 20. PREDICTING ION CHARGES In general • metals (Mg) lose electrons ---> cations • nonmetals (F) gain electrons ---> anions
  • 21. Charges on Common Ions +3 -4 -1 -2 -3 +1 +2 By losing or gaining e-, atom has same number of electrons as nearest Group 8A atom. Cation charge=group # Anion charge=group #-8
  • 22. Predicting Charges on Monatomic Ions
  • 23. METALS M ---> n e- + Mn+ where n = periodic group Na+ sodium ion Mg2+ magnesium ion Al3+ aluminum ion Transition metals --> M2+ or M3+ are common Fe2+ iron(II) ion Fe3+ iron(III) ion
  • 24. NONMETALS NONMETAL + n e- ------> Xn- where n = 8 - Group no. C4-,carbide N3-, nitride O2-, oxide S2-, sulfide F-, fluoride Cl-, chloride Group 7A Group 6A Group 4A Group 5A Br-, bromide I-, iodide
  • 26. POLYATOMIC IONS CD Screen 3.6 Groups of atoms with a charge. MEMORIZE the names and formulas of common polyatomic ions listed in Table 3.1, page 107 (next slide)
  • 28. Polyatomic Ions NH4 + ammonium ion One of the few common polyatomic cations
  • 29. Polyatomic Ions (oxoanions) HNO3 nitric acid NO3 - nitrate ion Prefix per- and suffix –ate: largest # Suffix -ate : greater # of oxygen atoms Suffix -ite : smaller # of oxygen atoms Prefix hypo- and suffix –ite: smallest #
  • 34. CATION + ANION ---> COMPOUND A neutral compd. requires equal number of + and - charges. COMPOUNDS FORMED FROM IONS Na+ + Cl- --> NaCl
  • 36. Some Ionic Compounds Mg2+ + NO3 - ----> Mg(NO3)2 magnesium nitrate Fe2+ + PO4 3- ----> Fe3(PO4)2 iron(II) phosphate calcium fluoride Ca2+ + 2 F- ---> CaF2
  • 37. Properties of Ionic Compounds Forming NaCl from Na and Cl2 • A metal atom can transfer an electron to a nonmetal. • The resulting cation and anion are attracted to each other by electrostatic forces.
  • 38. Electrostatic Forces The oppositely charged ions in ionic compounds are attracted to one another by ELECTROSTATIC FORCES. These forces are governed by COULOMB’S LAW.
  • 39. Electrostatic Forces COULOMB’S LAW Force of attraction = (charge on +)(charge on -) (distance between ions)2 As ion charge increases, the attractive force _______________. As the distance between ions increases, the attractive force ________________. This idea is important and will come up many times in future discussions!
  • 40. Importance of Coulomb’s Law NaCl, Na+ and Cl-, m.p. 804 oC MgO, Mg2+ and O2- m.p. 2800 oC
  • 41. ELEMENTS THAT EXIST AS MOLECULES See SCREEN 3.2 on the CD-ROM Allotropes of C
  • 43. ELEMENTS THAT EXIST AS DIATOMIC MOLECULES (gases)
  • 44. ELEMENTS THAT EXIST AS POLYATOMIC MOLECULES White P4 and polymeric red phosphorus S8 sulfur molecules
  • 45. Molecular Compounds Compounds without Ions CH4 methane CO2 Carbon dioxide BCl3 boron trichloride
  • 46. Naming Molecular Compounds CH4 methane BCl3 boron trichloride CO2 Carbon dioxide All are formed from two or more nonmetals. Ionic compounds generally involve a metal and nonmetal (NaCl)
  • 47. Empirical & Molecular Formulas A pure compound always consists of the same elements combined in the same proportions by weight. Therefore, we can express molecular composition as PERCENT BY WEIGHT Ethanol, C2H6O 52.13% C 13.15% H 34.72% O
  • 48. Percent Composition Consider some of the family of nitrogen- oxygen compounds: NO2, nitrogen dioxide and closely related, NO, nitrogen monoxide (or nitric oxide) Structure of NO2 Chemistry of NO, nitrogen monoxide
  • 49. Percent Composition Consider NO2, Molar mass = ? What is the weight percent of N and of O? Wt. % O  2 (16.0 g O per mole ) 46.0 g x 100%  69.6% Wt. % N = 14.0 g N 46.0 g NO2 • 100% = 30.4 % What are the weight percentages of N and O in NO?
  • 50. Determining Formulas In chemical analysis we determine the % by weight of each element in a given amount of pure compound and derive the EMPIRICAL or SIMPLEST formula. PROBLEM: A compound of B and H is 81.10% B. What is its empirical formula?
  • 51. • Because it contains only B and H, it must contain 18.90% H. • In 100.0 g of the compound there are 81.10 g of B and 18.90 g of H. • Calculate the number of moles of each constitutent. A compound of B and H is 81.10% B. What is its empirical formula?
  • 52. Calculate the number of moles of each element in 100.0 g of sample. 81.10 g B • 1 mol 10.81 g = 7.502 mol B 18.90 g H • 1 mol 1.008 g = 18.75 mol H A compound of B and H is 81.10% B. What is its empirical formula?
  • 53. Now, recognize that atoms combine in the ratio of small whole numbers Find the ratio of moles of elements in the compound. A compound of B and H is 81.10% B. What is its empirical formula?
  • 54. But we need a whole number ratio. 2.5 mol H/1.0 mol B = 5 mol H to 2 mol B EMPIRICAL FORMULA = B2H5 Take the ratio of moles of B and H. Always divide by the smaller number. 18.75 mol H 7.502 mol B = 2.499 mol H 1.000 mol B = 2.5 mol H 1.0 mol B A compound of B and H is 81.10% B. What is its empirical formula?
  • 55. A compound of B and H is 81.10% B. Its empirical formula is B2H5. What is its molecular formula ? Is the molecular formula B2H5, B4H10, B6H15, B8H20, etc.? B2H6 is one example of this class of compounds. B2H6
  • 56. A compound of B and H is 81.10% B. Its empirical formula is B2H5. What is its molecular formula? We need to do an EXPERIMENT to find the MOLAR MASS. Here experiment gives 53.3 g/mol Compare with the mass of B2H5 = 26.66 g/unit Find the ratio of these masses. 53.3 g/mol 26.66 g/unit of B2H5 = 2 units of B2H5 1 mol Molecular formula = B4H10
  • 57. How to Determine the molar mass? Mass spectrometer
  • 58. Mass Spectrum of Ethanol Mass Spectrum of Ethanol (from the NIST site) 46 45 CH3CH2OH+ CH3CH2O+ 31 CH2O+
  • 59. Determine the formula of a compound of Sn and I using the following data. • Reaction of Sn and I2 is done using excess Sn. • Mass of Sn in the beginning = 1.056 g • Mass of iodine (I2) used = 1.947 g • Mass of Sn remaining = 0.601 g
  • 60. Find the mass of Sn that combined with 1.947 g I2. Mass of Sn initially = 1.056 g Mass of Sn recovered = 0.601 g Mass of Sn used = 0.455 g Find moles of Sn used: 0.455 g Sn • 1 mol 118.7 g = 3.83 x 10-3 mol Sn Tin and Iodine Compound
  • 61. Tin and Iodine Compound Now find the number of moles of I2 that combined with 3.83 x 10-3 mol Sn. Mass of I2 used was 1.947 g. 1.947 g I2 • 1 mol 253.81 g = 7.671 x 10-3 mol I2 How many moles of iodine atoms? = 1.534 x 10-2 mol I atoms 7.671 x 10-3 mol I2 2 mol I atoms 1 mol I2      
  • 62. Tin and Iodine Compound Now find the ratio of number of moles of moles of I and Sn that combined. 1.534 x 10-2 mol I 3.83 x 10-3 mol Sn = 4.01 mol I 1.00 mol Sn Empirical formula is SnI4