KA1: Molecular orbitals Flashcards

1
Q

what theory can provide an explanation for bonding in more complex molecules?

A

molecular orbital theory

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2
Q

when do molecular orbitals form?

A

when atomic orbitals combine

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3
Q

the no. of molecular orbitals formed=

A

the no. of atomic orbitals that combine

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4
Q

what does the combination of two atomic orbitals result in?

A

bonding molecular orbital and an antibonding orbital

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5
Q

what does the bonding molecular orbital encompass?

A

both nuclei

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6
Q

what is the basis of bonding between atoms?

A

the attraction of the positively charged nuclei and the negatively charged electrons in the bonding molecular orbital

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7
Q

what is the max no. of electrons that each molecular orbital can hold?

A

2

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8
Q

describe the bonding molecular orbital in a non-polar covalent bond

A

symmetrical about the midpoint between two atoms

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9
Q

what do polar covalent bonds result from?

A

bonding molecular orbitals that are asymmetric about the midpoint between two atoms

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10
Q

the atom with the greater value for electronegativity has…

A

the greater share of bonding electrons

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11
Q

what are ionic compounds an extreme case of?

A

asymmetry

the bonding molecular orbitals almost entirely located around just one atom=resulting in the formation of ions

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12
Q

what are sigma (σ) molecular orbitals or sigma bonds?

A

orbitals bond end-on

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13
Q

what are pi (π) molecular orbitals or pi bonds?

A

orbitals bond side-on

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14
Q

what does the electronic configuration of an isolated carbon atom not explain?

A

the number of bonds formed by carbon atoms in molecules

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15
Q

what does hybridisation explain?

A

the bonding and shape of molecules of carbon

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16
Q

what is hybridisation?

A

the process of mixing atomic orbitals within an atom to generate a set of new atomic orbitals called hybrid orbitals

these hybrid orbitals are degenerate

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17
Q

in alkanes, what do the 2s orbital and the three 2p orbitals of carbon hybridise to form?

A

four degenerate sp3 hybrid orbitals

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18
Q

what arrangement do the four sp3 hydrid orbitals adopt?

A

tetrahydral

19
Q

what do the sp3 hybrid orbitals form and how to they do this?

A

-σ bonds

-overlap end-on with other atomic orbitals

20
Q

what can the bonding alkenes be described in terms of?

A

sp2 hydrisation

21
Q

when are three degenerate sp2 hybrid orbitals formed?

A

when the 2s orbital and two of the 2p orbitals hybridise

22
Q

what arrangement do the sp2 orbitlas adopt?

A

trigonal planar

23
Q

how do the hybrid sp2 orbitals overlap to form σ bonds?

A

end-on

24
Q

what happens to the remaining 2p orbital on each carbon atom on the double bond?

A

its unhybridised and lie perpendicular to the axis of the σ bond

the unhydridised p orbitals overlap side-on to form π bonds

25
Q

what can the bonding in benzene and other aromatic systems be described in terms of?

A

sp2 hybridisation

26
Q

describe the structure and bonding of the 6 carbons in benzene

A

-cyclic structure
-σ bonds between carbons

27
Q

what happens to the unhybridised p orbitals on each carbon atom?

A

-overlap side-on to form a π molecular system, perpendicular to the plane of the σ bonds

this molecular system extends across all six carbons

the electrons in this system are delocalised

28
Q

what can the bonding in alkynes be described in terms of?

A

sp hybridisation

29
Q

in alkynes, when are two degenerate hybrid orbitals formed?

A

2s orbital +one 2p orbital of carbon hybridise

30
Q

in alkynes, what arrangement do the 2s orbital and one 2p orbital adopt?

A

linear

31
Q

in alkynes, describe the structure and bonding in the 2s and 2p orbital

A

-hybrid sp orbitals overlap end-on to form σ bonds.

-the remaining two 2p orbitals on each carbon atom lie perpendicular to each oter and to the σ bond

-the unhybridised p orbitals overlap side-on to form two π bonds

32
Q

what theory can be used to explain why organic
molecules are colourless or coloured?

A

molecular orbital theory

33
Q

describe the order of filling of electrons

A

electrons fill bonding molecular orbitals, leaving higher energy antibonding orbitas unfilled

34
Q

what is the highest bonding molecular orbital (HOMO)?

A

the highest occupied molecular orbital containing electrons

35
Q

what is the lowest unoccupied molecular orbital (LUMO)?

A

the lowest antibonding molecular orbital

36
Q

what causes electrons to be promoted from HOMO to LUMO?

A

absorption of electromagnetic energy

37
Q

why do most organic molecules appear colourless?

A

energy difference between HOMO and LUMO is large

results in absorption of light from the ultraviolet region of the spectrum

38
Q

what do some organic molecules contain?

A

chromophores

39
Q

what is a chromophore?

A

a group of atoms within a molecule that is responsible for absorption of light in the visible region of the spectrum.

light can be absorbed when electrons in a chromophore are promoted from the HOMO to the LUMO.

40
Q

where do chromophores exist?

A

in molecules containing a conjugted system

41
Q

what is a conjugated system?

A

alternating single and double bonds

42
Q

which molecules have conjugated systems

A

molecules with alternating single and double bonds, and aromatic molecules have conjugated systems

43
Q

describe the relationship between conjugated systems and HUMO/LUMO

A

the more atoms in the conjugated system the smaller the energy gap between HOMO and LUMO

44
Q

explain the relationship between conjugated systems and HUMO/LUMO

A

A lower frequency of light (longer wavelength, lower energy) is absorbed by the compound. When the wavelength of light absorbed is in the visible region, the compound will exhibit the complementary colour