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Molecular Geometry • The properties of a compound are very much determined by the size and shape of its molecules. • Molecular geometry specifies the positions of the atoms in terms of bond lengths and bond angles. • We will focus on the molecular shape which depends on bond angles.

Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

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Page 1: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular Geometry• The properties of a compound are very much

determined by the size and shape of its molecules.

• Molecular geometry specifies the positions of the atoms in terms of bond lengths and bond angles.

• We will focus on the molecular shape which depends on bond angles.

Page 2: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular ModelsMolecular geometry can be represented in different ways.

Perspective drawing:

Ball and Stick:

Space filling:

Page 3: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

The VSEPR Model

• Valence Shell Electron Pair Repulsion is a simple but effective model for predicting molecular geometry.

• The first assumption of VSEPR is:

A molecule adopts the geometry that min- imizes the repulsive force among a given number of electron pairs.

Page 4: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Applying VSEPR

• Draw the Lewis structure of the molecule.

• Count the number of electron pairs around the central atom. Multiple bonds count as one electron pair.

• The arrangement of electron pairs that min- imizes repulsion is called the electron-pair geometry.

• The arrangement of atoms is called the molecular geometry.

Page 5: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Electron-Pair Geometries

#E.P.s Geometry

2 Linear

180

3 Trigonal Planar

120

4 Tetrahedral

109.5

Page 6: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Electron-Pair Geometries

#E.P.s Geometry

5 TrigonalBipyramidal

6 Octahedral

90

9090

120

QuickTime Movie

Page 7: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

The Trigonal Bipyramid

There are two positions, axial and equatorial, and two bond angles - 90and 120.

Page 8: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Some Basic GeometriesMole- Lewis EP Bond cule Structure Geometry Angle

2 - Linear 180CO2

SO2 3 - Trigonal Planar

120

CO3-2 3 - Trigonal

Planar120

Raswin molecule

Raswin molecule

Raswin molecule

O C O= =

O S O=

O S O=

O C O

O

-2

Page 9: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Some Basic GeometriesMole- Lewis EP Bond cule Structure Geometry Angle

CH4 4 - Tetra-hedral

109.5

Raswin molecule

H C H

H

H

NH3 4 - Tetra-hedral

109.5

Raswin molecule

H N H

H

Page 10: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Some Basic GeometriesMole- Lewis EP Bond cule Structure Geometry Angle

SF4 5 -Trigonal Bipyra- midal

90,120

XeF4 6 - Octa-hedral

90

Raswin molecule

Raswin molecule

F S F

F

F

F Xe F

F

F

Page 11: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Distortions from Ideal GeometryFurther assumptions of VSEPR:

• Nonbonding EPs exert a greater repulsive force than bonding EPs.

• Multiple bonds exert a greater repulsive force than single bonds.

• Example: H2O OHH

104.5

Page 12: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecules With More than One Central AtomThe geometry around each central atom must be determined.

HC2H3O2:

Trigonal planar

Tetrahedral

H C C O H

H

H

O

Page 13: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular Dipole Moments• A molecule is polar if its centers of positive

and negative charge are separated.

• Polarity causes a neutral molecule to interact with ions or other dipoles.

• Dipoles in an electric

field:

Page 14: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular Dipole MomentsFor polyatomic molecules, the dipole moment is the geometric sum of all bond dipole moments.

CO2 - Nonpolar H2O - Polar

Page 15: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular Dipole MomentsAre the following polar or nonpolar?

BF3: Trigonal Planar

Nonpolar

CH2O: Trigonal Planar

F B F

F

H C H

O

B

F

F F

120

C

O

H HPolar

120

Page 16: Molecular Geometry The properties of a compound are very much determined by the size and shape of its molecules. Molecular geometry specifies the positions

Molecular Dipole MomentsAre the following polar or nonpolar?

CCl4: Tetrahedral

Nonpolar

CH3Cl: Tetrahedral

Polar

Cl C Cl

Cl

Cl

H C H

H

Cl

C

Cl

Cl ClCl

109

C

Cl

H HH