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    P10 11b

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    Prayoga Agusto
    1) The reaction involves a dual-site mechanism where cyclohexanol adsorbs onto the catalyst surface and reacts to form cyclohexene and water. 2) The rate law was determined to be -rA = kPA/(1 + KAPA + KBPB + KHPH)2, consistent with a dual-site surface reaction mechanism. 3) The rate constants were estimated as k = 0.0014, KA = 4.773, KB = 0.2625, KH = 0.4233 based on non-linear regression analysis.

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    P10 11b

    Uploaded by

    Prayoga Agusto
    170 views4 pages
    1) The reaction involves a dual-site mechanism where cyclohexanol adsorbs onto the catalyst surface and reacts to form cyclohexene and water. 2) The rate law was determined to be -rA = kPA/(1 + KAPA + KBPB + KHPH)2, consistent with a dual-site surface reaction mechanism. 3) The rate constants were estimated as k = 0.0014, KA = 4.773, KB = 0.2625, KH = 0.4233 based on non-linear regression analysis.

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    Original Title

    P10-11b

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    1) The reaction involves a dual-site mechanism where cyclohexanol adsorbs onto the catalyst surface and reacts to form cyclohexene and water. 2) The rate law was determined to be -rA = kPA/(1 + KAPA + KBPB + KHPH)2, consistent with a dual-site surface reaction mechanism. 3) The rate constants were estimated as k = 0.0014, KA = 4.773, KB = 0.2625, KH = 0.4233 based on non-linear regression analysis.

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    © All Rights Reserved
    Download as DOCX, PDF, TXT or read online from Scribd
    Download as docx, pdf, or txt
    170 views4 pages

    P10 11b

    Uploaded by

    Prayoga Agusto
    1) The reaction involves a dual-site mechanism where cyclohexanol adsorbs onto the catalyst surface and reacts to form cyclohexene and water. 2) The rate law was determined to be -rA = kPA/(1 + KAPA + KBPB + KHPH)2, consistent with a dual-site surface reaction mechanism. 3) The rate constants were estimated as k = 0.0014, KA = 4.773, KB = 0.2625, KH = 0.4233 based on non-linear regression analysis.

    Copyright:

    © All Rights Reserved
    Download as DOCX, PDF, TXT or read online from Scribd
    Download as docx, pdf, or txt
    of 4

    P10-11B (Kezia Dara Euodia 1406567914)

    Cyclohexanol was passed over a catalyst to form water and cyclohexene:


    Cyclohexanol Water + Cyclohexene
    The following data were obtained.
    Reaction Rate
    Run
    (mol/dm3.s) x105
    1 3.3 1 1 1
    2 1.05 5 1 1
    3 0.565 10 1 1
    4 1.826 2 5 1
    5 1.49 2 10 1
    6 1.36 3 0 5
    7 1.08 3 0 10
    8 0.862 1 10 10
    9 0 0 5 8
    10 1.37 3 3 3
    It is suspected that the reaction may involve a dual-site mechanism, but it is not know
    for certain. It is believed that the adsorption equlibrium constant for cyclohexanol is
    around 1 and is roughly one or two orders of magnitude greater than the adsorption
    equilibrium constants for the compounds. Using these data:
    a. Suggest a rate law and mechanism consistent with the data given here.
    b. Determine the constants needed for the rate law.
    c. Why do you think estimated of the rate law parameters were given?

    Penyelesaian
    a. Mekanisme laju reaksi
    Cyclohexanol Water + Cyclohexene
    AB+H
    Mekanisme reaksi yang berlangsung adalah:
    .
    Adsorpsi : + . = ( )

    . .
    Reaksi permukaan : . + . + . = (. )


    Desorpsi : . + = (. )


    . + = (. )

    Diasumsikan tahap penentu adalah reaksi permukaan dengan persamaan laju:


    . .
    = = (. ) (1)

    Untuk menentukan . , . , dan . maka:

    ~0 . = (2)


    ~0 . = (3)


    ~0 . = (4)

    Jika persamaan tersebut disubsitusikan ke persamaan laju reaksi (1), maka akan
    diperoleh:
    2
    = = ( 2 )


    = 2 ( ) (5)

    Neraca active site yang berlaku adalah: = + . + . + . . Sehingga,
    subsitusi dengan nilai . , . , dan . dari persamaan (2), (3), dan (4):

    = + + +


    = (1 + + + )


    = (6)

    (1 + + + )

    Dengan mensubsitusikan persamaan (6) ke persamaan (5), akan diperoleh:


    2


    = ( ) ( )

    (1 + + + )

    2
    =
    (1 + + + )2
    Jika = 2 , maka:

    = (7)
    (1 + + + )2

    Dari persamaan (7), terlihat bahwa reaksi yang berlangsung adalah surface reaction
    dual-site. Pengecekan terhadap asumsi awal berupa reaksi penentu adalah reaksi
    permukaan dapat dilihat dari nilai yang meningkat menyebabkan penurunan laju
    reaksi seperti terlihat pada run 1 ke 2. Sementara itu, niali yang meningkat seperti
    pada run 4 ke 5 terjadi pengurangan laju reaksi, dan nilai yang meningkat seperti
    pada run 6 ke 7 menyebabkan penurunan laju reaksi. Hal ini sesuai dengan asumsi
    awal.

    b. Menentukan konstanta laju reaksi


    Pada persamaan laju reaksi, terdapat konstanta , , , dan . Nilai tersebut dapat
    diperoleh menggunakan perhitungan program Polymath dengan opsi non-linear
    regression. Sehingga diperoleh:

    = 0,0013767 0,0014
    = 4,773088 4,773
    = 0,2624555 0,2625
    = 0,4233203 0,4233
    0,0014
    = 2
    =
    (1 + + + ) (1 + 4,773 + 0,2625 + 0,4233 )2
    Pada kasus ini, nilai diperkirakan lebih besar satu atau dua order dari nilai
    dan . Asumsi itu dibuktikan pada perolehan nilai konstanta, sehingga pernyataan
    tersebut benar.
    c. Mengapa estimasi parameter laju reaksi diberikan
    Estimasi parameter laju reaksi diberikan pada soal untuk mempermudah pencarian
    dan konvergen dengan nilai kesalahan kecil. Pada kenyataannya, estimasi tersebut
    tidak akan diberikan dan harus melakukan uji coba pada setiap kemungkinan yang
    ada.

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