Chemistry Reference
In-Depth Information
FIGURE 14.10 Schematic potential energy surface for the CN/CH 3 CCCH 3 system
(adapted from Reference 78 ).
!
CH 2 ¼
¼
ð
CH 3 Þ
þ
ð
:
Þ
C
C
NC
H
14
10d
!
CH 3
C
¼
C
¼
CH 2 þ
HCN
ð
14
:
10e
Þ
!
CH 3
C
¼
C
¼
CH 2 þ
HNC
ð
14
:
10f
Þ
We have carried out aCMB experiment at a collision energy of 20.8 kJ/mol
[78]. We observed reactive scattering signal at m/e
79, corresponding to
the ion C 5 H 5 N þ . A reactive signal was observed at lower m/e values between
78 and 74 as well, but the TOF spectra recorded at those values showed
identical patterns to the one at m/e
¼
79, thus implying that they derive from
dissociative ionization of the same species. Also, in this case, the adduct
C 5 H 6 N could not be observed. We also put a lot of effort into an attempt to
search for the methyl loss channel and checked for m/e
¼
65 (C 4 H 3 N þ ).
Unfortunately, this channel could not be detected experimentally. Based on
the weak reactive scattering signal for the H-loss channel, the unfavourable
kinematics of the CH 3 -loss channel, and their predicted branching ratio (see
below), we estimate that data accumulation times of at least 50 h at the CM
angle is necessary to obtain a signal-to-noise ratio comparable to that of
the H-atom loss channel. Such a long accumulation time for a single TOF
spectrum makes the measurements of the LAB distributions at m/e
¼
¼
65
not feasible.
In
Figure 14.11
the LAB product angular distribution recorded at
50 . The
solid lines superimposed on the experimental results are the calculated
m/e
¼
78 is shown together with the TOF spectrum recorded at
Y ¼
curves when using the CM best-fit functions of Figure 14.12 . The LAB
angular distribution of the heavy C 5 H 5 N fragment is relatively narrow. If we
 
 
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