Infrared Spectroscopy: AND Principle, Instrumentation

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INFRARED INTRODUCTION

AND
SPECTROSCOPY PRINCIPLE, INSTRUMENTATION
PRESENTEDBY
AMMARAASLAM
GULYASMIN
HAFIZAHADIA
PRESENTEDTO GULSHAN
DR. SHABIRHUSSAIN

2 semester
nd
IR spectroscopydeals withthe
infraredregionof the
electromagnetic spectrum, i.e. light
havinga longer wavelengthanda
INFRARED lower frequencythanvisiblelight.
SPECTROSCOPY
InfraredSpectroscopygenerally
refersto theanalysis of the
interactionof a moleculewith
infraredlight.
Chemical compoundshavedifferent chemical propertiesduetothepresence
of differentfunctional groups.

Themajoruseof infraredspectroscopyistodeterminethefunctional groups


of molecules, relevant tobothorganicandinorganicchemistry.

IRspectroscopycanbeverysensitivetodeterminationof functional groups


withinasamplesincedifferentfunctional groupabsorbsdifferentparticular
frequencyofIRradiation.
Also, eachmoleculehasacharacteristicspectrumoftenreferredtoasthe
fingerprint.

A moleculecanbeidentifiedbycomparingitsabsorptionpeaktoadatabank
of spectra.

IRspectroscopyisveryuseful intheidentificationandstructureanalysisof a
varietyof substances, includingbothorganicandinorganiccompounds.
Wheninfrared'light' orradiationhitsamolecule, thebondsinthe
moleculeabsorbtheenergyof theinfraredandrespondbyvibrating.
Inabsorptionprocessfrequenciesof infraredradiationthatmatchthe
natural vibrationfrequenciesof themolecule, areabsorbedandthis
principle absorptioncauseincreaseinamplitudeof vibrational motionof
molecules.
OnlytheMoleculesthat possessdipolemoment, absorbIRradiations
Symmetric bondslikeH2 ORCl2donotabsorbinfraredradiations.
Inordertoabsorbtheelectromagneticradiationfor a
moleculethefrequencyof theincident radiationmatches
thenatural frequencyof thevibration, theIRphotonis
absorbedandtheamplitudeof thevibrationincreases.
Requirement of Thedipolemomentof themoleculemustchangeasa
molecule result ofamolecularvibration. Thechangeinthedipole
moment allowsinteractionwiththealternatingelectrical
component oftheIRradiationwave.

Symmetricmolecules(orbonds) donot absorbIR


radiationsincethereisnodipolemoment.
TheIRSpectrumRegions
Therearetwotypeof IRSpectrafromwhichwecanobtainedtheinformationabout molecule.
1. TheFunctional Groupregion: Identifiesthefunctional groupwiththeconsequenceof changingstretching
vibrations. Rangesfrom4000to1300cm-1.
2. TheFingerprint region: Identifiestheexact moleculewiththeconsequenceof changingbendingvibrations.
Rangesfrom1300to400cm-1.
Regionsof IRspectrum
Structural informationabout acompound
ismainlyderivedfromthepresenceor
absenceof characteristicsabsorption
bandsof variousfunctional groupsinthe
IRSpectrumof thecompound.
Interpretationof
IRSpectra Aknowledgeof thebandof all themajor
functional groupswill bevaluable. The
bandpositionof all themajorstructural
bondingtypeshavebeendeterminedina
tabularform.
Vibrational frequencyandHooke’s Law
Wecanalsocalculatean approximatevalueof thestretchingvibrational
frequencyof a bondbytreatingthetwoatomsandtheir connectingbond, tofirst
approximation, as twoballsconnectedbya spring, actingas a simpleharmonic
oscillator for whichtheHooke’sLawmaybeapplied.
AccordingtoHooke’sLaw,
TheStretchingfrequencyis relatedtothemassesof theatomandtheforce
constant(ameasureof resistanceof a bondtostretching) of a bondbythe
followingequation
AccordingtoHookeslaw
1. StrongerbondshavealargerforceconstantKand vibrateathigher
frequenciesthanweakerbonds.
2. Bondsbetweenatomsofhighermassesvibrateatlowerfrequenciesthan
bondsbetweenlighteratoms.
TheInfraredSpectrometer
Two typesofinfraredspectrometers areincommonuseinthe
organiclaboratory
1. Dispersive Infraredspectrometer
2. Fouriertransform( FT ) Infraredspectrometer
Bothof thesetypesof instrumentsprovidespectraofcompounds in
commonrangeof4000to400cm- ι
DispersiveInfraredSpectrometers
Theinstrumentproducesabeamof infraredradiationfromahotwire.
Bymeansofmirrors, dividesit intotwoparallel beamsof equal-intensityradiation.
Thesampleisplacedinonebeam, andtheotherbeamis usedasareference.
Thebeamsthenpassintothemonochromator, whichdisperseseachintoacontinuousspectrum
of frequenciesof infraredlight.
Themonochromatorconsistsof arapidlyrotatingsector(beamchopper) that passesthetwo
beams alternatelytoadiffractiongrating(aprisminolderinstruments).
• Theslowlyrotatingdiffractiongratingvariesthefrequencyorwavelength
of radiationreachingthethermocoupledetector.
Thedetectorsensestheratiobetweentheintensitiesof thereferenceand
samplebeams.
• Inthisway, thedetectordetermineswhichfrequencieshavebeen
absorbedbythesampleandwhichfrequenciesareunaffectedbythelight
passingthroughthesample.
• Afterthesignal fromthedetectorisamplified, therecorderdrawsthe
resultingspectrumof thesampleonachart.
Aschematicdiagramof theclassical dispersiveIRspectrophotometer.
FT-IR- FOURIERTRANSFORMINFRARED
• Fouriertransforminfrared, morecommonlyknownasFT-IR, isthepreferred
methodforinfraredspectroscopy.
• Developedinordertoovercometheslowscanninglimitationsencounteredwith
dispersiveinstruments, withFT-IRtheinfraredradiationispassedthrougha
sample.
• Themeasuredsignal isreferredtoasaninterferogram.

• PerformingaFouriertransformonthissignal dataresultsinaspectrumidentical
tothat fromconventional (dispersive)infraredspectroscopy
• Theresultsaremuchfasterwithresultsinseconds, ratherthanminutes.
• Thedesignof theoptical pathwayproducesapatterncalledaninterferogram.
• Theinterferogramis acomplexsignal, but itswave-likepatterncontainsall thefrequenciesthat
makeuptheinfraredspectrum.

• Aninterferogramisessentiallyaplotof intensityversustime(atime-domainspectrum).
• However, achemist ismoreinterestedinaspectrumthatis aplotof intensityversusfrequency
(afrequency-domainspectrum). Amathematical operationknownasaFouriertransform(FT) .

• It canseparatetheindividual absorptionfrequenciesfromtheinterferogram, producinga


spectrumvirtuallyidentical tothatobtainedwithadispersivespectrometer.

• Thistypeof instrumentis knownasaFouriertransforminfraredspectrometer, orFT-IR.


Schematicdiagramof typical FTIRspectrophotometer

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