Kinetics Database Logo

Kinetics Database Resources

Simple Reaction Search

Search Reaction Database

Search Bibliographic Database

Set Unit Preferences

Feedback

Rate Our Products and Services

Help


Other Databases

NIST Standard Reference Data Program

NIST Chemistry Web Book

NDRL-NIST Solution Kinetics Database

NIST Computational Chemistry Comparison and Benchmark Database

The NIST Reference on Constants, Units, and Uncertainty

More...


Administrative Links

NIST home page

MML home page

Chemical Sciences Division

  NIST Logo Home
©NIST, 2013
Accessibility information
Author(s):   Li, S.P.;Fan, W.Y.
Title:   FTIR and computational studies of gas-phase hydrogen atom abstraction kinetics by t-butoxy radical
Journal:   Chem. Phys. Lett.
Volume:   427
Page(s):   276 - 280
Year:   2006
Reference type:   Journal article
Squib:   2006LI/FAN276-280

Associated entries:

Search Results


Rate expression:  k(T) = A (T/298 K)n e-Ea/RT
Rate expression units:
First order:  s-1
Second order:  cm3/molecule s
Third order:  cm6/molecule2 s
R = 8.314472 J / mole K
Energy Units J   Molecular Units Molecule
Pressure Units bar   Temperature Units K
Base Volume Unit cm   Reference Temperature 298.0
Evaluation Temperature 298.0

Use the Plot checkboxes to select data for plotting. Plot selected data using the "Create Plot" button. Click the squib to see extra information about a particular rate constant. Additional help is available.

| |
Plot   Squib   Reaction   Temp [K]   A   n   Ea [J/mole]   k(298.00 K)   Order
  2006LI/FAN276-280   CHCl3 + (CH3)3CO· → tert-C4H9OH + ·CCl3  299   3.80E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   CHCl3 + (CH3)3CO· → tert-C4H9OH + ·CCl3  297 - 318   1.66E-12       1.80E04   1.16E-15  2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   CHBr3 + (CH3)3CO· → tert-C4H9OH + CBr3  299   2.70E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   CH2Cl2 + (CH3)3CO· → tert-C4H9OH + CHCl2  299   2.50E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   n-C3H7CN + (CH3)3CO· → Products + tert-C4H9OH  299   2.10E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   1-C6H12 + (CH3)3CO· → Products + tert-C4H9OH  299   1.60E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   Toluene + (CH3)3CO· → Products + tert-C4H9OH  299   1.60E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   C2H2 + (CH3)3CO· → tert-C4H9OH + ·C2H  299   1.40E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   Phenylacetylene + (CH3)3CO· → Products + tert-C4H9OH  299   1.40E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   CH3CN + (CH3)3CO· → tert-C4H9OH + CH2CN  299   6.20E-16              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   (CH3)2NCH2CH2NH2 + (CH3)3CO· → Products + tert-C4H9OH  299   4.50E-14              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   (C2H5)3N + (CH3)3CO· → Products + tert-C4H9OH  299   4.90E-14              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   Cyclohexanamine + (CH3)3CO· → Products + tert-C4H9OH  299   2.50E-14              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   n-C3H7NH2 + (CH3)3CO· → Products + tert-C4H9OH  299   7.80E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   iso-C3H7CN + (CH3)3CO· → Products + tert-C4H9OH  299   5.60E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   1-C6H14 + (CH3)3CO· → Products + tert-C4H9OH  299   2.70E-15              2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   1-C6H14 + (CH3)3CO· → Products + tert-C4H9OH  297 - 318   1.66E-11       2.17E04   2.61E-15  2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   iso-C3H7CN + (CH3)3CO· → Products + tert-C4H9OH  297 - 318   1.31E-12       1.65E04   1.68E-15  2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1
  2006LI/FAN276-280   (C2H5)3N + (CH3)3CO· → Products + tert-C4H9OH  297 - 318   8.30E-14       2780   2.70E-14  2
  Reference reaction:  (CH3)3CO· → Acetone + ·CH3 1

Search returned 19 records.