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Details
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Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| expt-0 sdbs | Prediction 1 hose_lotusv7 |
5
|
S |
158.8 |
| 158.9 | 163.5 |
6
|
S |
158.8 |
| 163.5 |
7
|
D |
119.6 |
| 121.1 | 122.23 |
8
|
D |
119.6 |
| 122.23 |
9
|
D |
137.3 |
| 137.34 | 136.09 |
10
|
D |
137.3 |
| 136.09 |
11
|
D |
121.1 |
| 119.69 | 119.95 |
12
|
D |
121.1 |
| 119.95 |
13
|
D |
149.5 |
| 149.52 | 148.5 |
14
|
D |
149.5 |
| 148.5 |
|
|
Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| expt-0 sdbs | Prediction 1 acd_lotusv7 |
5
|
S |
163.50 |
| 158.9 | 158.8 |
6
|
S |
163.50 |
| 158.8 |
7
|
D |
122.23 |
| 121.1 | 119.6 |
8
|
D |
122.23 |
| 119.6 |
9
|
D |
136.09 |
| 137.34 | 137.3 |
10
|
D |
136.09 |
| 137.3 |
11
|
D |
119.95 |
| 119.69 | 121.1 |
12
|
D |
119.95 |
| 121.1 |
13
|
D |
148.50 |
| 149.52 | 149.5 |
14
|
D |
148.50 |
| 149.5 |
|
|
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