Spectroscopy Topic 2 Flashcards

1
Q

How to calculate reduced mass?

A
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2
Q

How to calculate frequency of vibration?

A

k-force constant

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3
Q

How we get higher IR absorption frequesncy (wavenumber)?

A

By increasing force constant and by lowering atomic mass

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4
Q

What are the subregions of IR spectroscopy?

A

4000-2500 cm-1 X-H bonds

2500-1900 cm-1 triple bonds

1900-1500 cm-1 double bonds

1500-400 cm-1 fingerprint region

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5
Q

What is absorption band of alcohols and phenols in IR?

A

3200-3600 cm-1, very broad

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6
Q

What is absorption band of carboxylic acids in IR?

A

2500-3000 cm-1, very broad

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7
Q

What is absorption band of amines and amides in IR?

A

3300-3500 cm-1, broad

10 amines/amides show two bands

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8
Q

What is absorption band of C-H bond in IR?

A

sp3<3000 cm-1

sp2 and sp >3000 cm-1

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9
Q

What is meanind of aldehydic?

A

Having a character of aldehyde

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10
Q

What is absorption band of aldehydic C-H bonds in IR?

A

2700-2900 cm-1, often shows two bands

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11
Q

What is absorption band of S-H bonds in IR?

A

2550-2600 cm-1, weak and not very broad

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12
Q

What is absorption band of C≡C and C≡N bonds in IR?

A

2100-2260 cm-1 , medium band

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13
Q

What is absorption band of C=C bonds in IR?

A

For non-conjugated 1620-1680 cm-1, weak-medium band. Conjugation lowers by 40 cm-1

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14
Q

What is absorption band of C=O bonds in IR?

A

1800-1650cm-1, strong absorption band

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15
Q

What is absorption band of acid chlorides in IR?

A
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16
Q

What is absorption band of anhydrides in IR?

A

1750-1820 cm-1, 2 bands

17
Q

What is absorption band of esters in IR?

A

1735-1750 cm-1

18
Q

What is absorption band of aldehydes in IR?

A

1720-1740 cm-1

19
Q

What is absorption band of ketones in IR?

A

1705-1720 cm-1

20
Q

What is absorption band of carboxylic acids in IR?

A

1700-1725 cm-1

21
Q

What is absorption band of amides in IR?

A

1670-1700 cm-1

22
Q

Why absorption band of C=O depends on functional groups?

A

The stronger C=O bond the hugher the absorption band

23
Q

How conjugation afects absorption?

A

it lowers by ~ 20 cm-1, except for amides where it’s increased by ~ 15 cm-1

24
Q

What is the efect of ring size on cyclic ketone absorption for C=O stretch?

A

As the ring size gets smaller, bond strength increases due to the increased p character of bonds in smaller rings. The external C=O bond increases in s character to compensate, which results in stronger bonds and higher frequency.

25
Q

What is absorption band of C-O in IR?

A

1000-1300 cm-1, medium to strong absorption

26
Q

What is absorption band of N-O stretch in NO2 in IR?

A

medium to strong absorption 1300-1400 cm-1, and strong absorption 1500-1600 cm-1

27
Q

What is absorption band of C-Cl bonds in IR?

A

600-800 cm-1, weak

28
Q

What is the absorption for organic molecules in UV/Vis spectroscopy?

A

above 200 nm, due to the presence of conjugated double bonds/ delocalisation. The electrons generally transition between π and π* MOs in this case.

29
Q

What is the absorption for unconjugated carbonyl compounds in UV/Vis spectroscopy?

A

Around 300 nm, due to an n - π* transition. This is usually very weak and therefore of limited diagnostic use.

30
Q

What is the absorption for benzene in UV/Vis spectroscopy?

A

Benzene has a conjugated π-system that gives a reasonable absorption at 255 nm. This can be shifted to higher wavelength by substituents that modulate electron distribution through the molecule.

31
Q

What the presence of a significant UV absorption above approximately 200 nm indicates?

A

It indicates a conjugated π-system within the molecule