List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
224840 |
85447540 |
1 |
O3C7H8 |
A3B7C8 |
-92.89 |
3.9 |
-10.89 |
0.3 |
0 |
|
|
224841 |
85451356 |
1 |
ClON2C15H15 |
ABC2D15E15 |
-0.95 |
3.98 |
-9.43 |
-1.09 |
0 |
|
|
224842 |
85455323 |
1 |
ClO3N4C17H21 |
AB3C4D17E21 |
-33.28 |
8.02 |
-8.48 |
-1.68 |
1 |
|
|
224844 |
85460328 |
1 |
ClN2O3C24H29 |
AB2C3D24E29 |
-80.92 |
4.11 |
-8.59 |
-0.57 |
0 |
|
|
224845 |
85462449 |
1 |
N4O4H16C21 |
A4B4C16D21 |
10.65 |
7.84 |
-9.24 |
-1.63 |
0 |
|
|
224847 |
85464524 |
2 |
ON2C11H13 |
AB2C11D13 |
-26.05 |
4.21 |
-8.51 |
0.28 |
0 |
|
|
224848 |
85470612 |
1 |
OF2N4C10H10 |
AB2C4D10E10 |
-43.99 |
4.22 |
-9.65 |
-1.42 |
0 |
|
|
224849 |
85471305 |
1 |
N3O11C43H81 |
A3B11C43D81 |
-572.86 |
3.18 |
-8.56 |
0.68 |
1 |
|
|
224850 |
85473759 |
1 |
N4O4C21H31 |
A4B4C21D31 |
-109.54 |
1.93 |
0.0 |
0.0 |
0 |
|
|
224852 |
85475341 |
1 |
O2N6H16C21 |
A2B6C16D21 |
110.02 |
7.89 |
-9.13 |
-1.74 |
0 |
|
|
224853 |
85480568 |
1 |
ON4C22H34 |
AB4C22D34 |
-39.42 |
4.29 |
-8.49 |
-0.02 |
0 |
|
|
224854 |
85483828 |
2 |
BrNOH2C4 |
ABCD2E4 |
-26.13 |
5.16 |
-10.65 |
-2.55 |
0 |
|
|
224855 |
85484373 |
1 |
NO3C22H29 |
AB3C22D29 |
-117.61 |
3.69 |
-8.35 |
-0.38 |
1 |
|
|
224856 |
85488184 |
1 |
BrNOC25H35 |
ABCD25E35 |
-7.42 |
9.71 |
0.0 |
0.0 |
1 |
|
|
224858 |
85489304 |
1 |
O3N5C21H39 |
A3B5C21D39 |
-177.37 |
5.82 |
-9.14 |
0.16 |
-1 |
|
|
224859 |
85498063 |
1 |
OS2N4C13H15 |
AB2C4D13E15 |
82.2 |
6.42 |
0.0 |
0.0 |
0 |
|
|
224860 |
85501766 |
1 |
ClSN3O3H22C24 |
ABC3D3E22F24 |
-12.64 |
2.18 |
-9.1 |
-1.1 |
0 |
|
|
224861 |
85502550 |
1 |
ClSO2N3H12C16 |
ABC2D3E12F16 |
16.11 |
2.45 |
-9.02 |
-1.15 |
0 |
|
|
224863 |
85507135 |
1 |
N2O6C25H28 |
A2B6C25D28 |
-129.69 |
3.02 |
-7.85 |
-0.69 |
0 |
|
|
224864 |
85507136 |
1 |
ClSO2N6H13C16 |
ABC2D6E13F16 |
66.1 |
7.4 |
-9.39 |
-1.79 |
0 |
|
|
224865 |
85518291 |
1 |
FON2H19C20 |
ABC2D19E20 |
-20.84 |
4.03 |
-8.42 |
-0.78 |
0 |
|
|
224868 |
85523663 |
2 |
NO2C9H9 |
AB2C9D9 |
-91.45 |
6.49 |
-9.14 |
-0.15 |
0 |
|
|
224869 |
85529195 |
1 |
NOSH15C19 |
ABCD15E19 |
39.0 |
3.02 |
-8.55 |
-1.73 |
0 |
|
|
224870 |
85532538 |
1 |
O5C10H16 |
A5B10C16 |
-238.38 |
4.71 |
-10.5 |
-0.15 |
0 |
|
|
224871 |
85532684 |
1 |
OSH20C23 |
ABC20D23 |
98.66 |
2.97 |
-8.53 |
-1.28 |
0 |