List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
5335 |
12990 |
1 |
OC6H10 |
AB6C10 |
-43.21 |
3.33 |
-10.06 |
-0.03 |
0 |
|
|
5336 |
12991 |
1 |
OC4H6 |
AB4C6 |
-3.21 |
2.86 |
-10.25 |
1.25 |
0 |
|
|
5337 |
12992 |
2 |
C4H7 |
A4B7 |
-9.14 |
0.02 |
-8.23 |
0.88 |
0 |
|
|
5338 |
12994 |
2 |
HNC2 |
ABC2 |
79.75 |
0.0 |
-11.65 |
-1.53 |
0 |
|
|
5339 |
12995 |
2 |
OC2H4 |
AB2C4 |
-75.75 |
1.34 |
-9.6 |
1.04 |
0 |
|
|
5340 |
12998 |
1 |
O3C8H14 |
A3B8C14 |
-95.81 |
0.66 |
-9.55 |
0.9 |
0 |
|
|
5341 |
13000 |
1 |
BrC13H27 |
AB13C27 |
-63.56 |
1.96 |
-10.4 |
0.03 |
0 |
|
|
5342 |
13002 |
1 |
O2C3H4 |
A2B3C4 |
-34.83 |
1.88 |
-10.39 |
-0.32 |
0 |
|
|
5343 |
13003 |
1 |
NC5H11 |
AB5C11 |
-16.09 |
1.95 |
-9.02 |
3.13 |
0 |
|
|
5344 |
13005 |
2 |
OC3H4 |
AB3C4 |
-88.24 |
1.8 |
-10.19 |
0.19 |
0 |
|
|
5345 |
13006 |
2 |
OC3H4 |
AB3C4 |
-77.87 |
4.94 |
-9.63 |
-0.36 |
0 |
|
|
5346 |
13007 |
1 |
NC7H15 |
AB7C15 |
-21.07 |
1.48 |
-8.48 |
2.99 |
0 |
|
|
5347 |
13009 |
2 |
OC3H6 |
AB3C6 |
-108.35 |
2.37 |
-9.95 |
2.0 |
0 |
|
|
5348 |
13010 |
3 |
OC2H2 |
AB2C2 |
-106.52 |
5.77 |
-11.09 |
-1.6 |
0 |
|
|
5349 |
13012 |
1 |
ClOC7H11 |
ABC7D11 |
-68.51 |
5.09 |
-10.11 |
0.24 |
0 |
|
|
5350 |
13013 |
1 |
NO2C6H11 |
AB2C6D11 |
-67.77 |
2.71 |
-10.41 |
0.54 |
0 |
|
|
5351 |
13015 |
1 |
ClNH4C7 |
ABC4D7 |
46.31 |
3.38 |
-10.07 |
-1.04 |
0 |
|
|
5352 |
13016 |
1 |
SC8H10 |
AB8C10 |
18.29 |
1.51 |
-8.56 |
0.12 |
0 |
|
|
5353 |
13017 |
1 |
NOC7H13 |
ABC7D13 |
-62.88 |
4.11 |
-9.76 |
1.08 |
0 |
|
|
5354 |
13023 |
2 |
C5H6 |
A5B6 |
6.41 |
0.93 |
-9.02 |
0.53 |
0 |
|
|
5355 |
13024 |
10 |
CH |
AB |
34.81 |
0.81 |
-8.88 |
0.02 |
0 |
|
|
5356 |
13025 |
10 |
CH |
AB |
29.98 |
0.45 |
-8.77 |
0.09 |
0 |
|
|
5357 |
13030 |
2 |
C5H6 |
A5B6 |
18.2 |
1.52 |
-9.1 |
0.54 |
0 |
|
|
5358 |
13031 |
1 |
OC9H14 |
AB9C14 |
-55.46 |
3.05 |
-9.34 |
0.66 |
0 |
|
|
5359 |
13033 |
2 |
C5H6 |
A5B6 |
27.26 |
0.21 |
-9.33 |
0.4 |
0 |