List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275700 |
103817162 |
1 |
ClO2N4C11H15 |
AB2C4D11E15 |
-65.1 |
4.33 |
-10.1 |
-1.46 |
0 |
|
|
275701 |
103817166 |
1 |
ClON5C10H10 |
ABC5D10E10 |
31.53 |
5.44 |
-9.08 |
-1.58 |
0 |
|
|
275702 |
103817171 |
1 |
ClN4O4C11H13 |
AB4C4D11E13 |
-76.47 |
5.38 |
-10.45 |
-2.3 |
0 |
|
|
275703 |
103817174 |
1 |
ClON3C15H16 |
ABC3D15E16 |
17.33 |
4.42 |
-9.6 |
-1.36 |
0 |
|
|
275704 |
103817175 |
1 |
BrON3C12H12 |
ABC3D12E12 |
9.36 |
8.12 |
-8.67 |
-0.29 |
0 |
|
|
275705 |
103817181 |
1 |
N3O3C9H13 |
A3B3C9D13 |
-103.6 |
4.43 |
-9.62 |
0.04 |
0 |
|
|
275706 |
103817184 |
1 |
ClO3N4H11C13 |
AB3C4D11E13 |
-62.15 |
5.05 |
-9.02 |
-1.8 |
0 |
|
|
275707 |
103817189 |
1 |
Cl2O2N4H10C13 |
A2B2C4D10E13 |
-22.7 |
3.44 |
-9.31 |
-1.89 |
0 |
|
|
275708 |
103817193 |
1 |
ClFN3O3H9C13 |
ABC3D3E9F13 |
-30.38 |
3.99 |
-9.39 |
-2.27 |
0 |
|
|
275709 |
103817200 |
1 |
ClN3O5C12H14 |
AB3C5D12E14 |
-113.1 |
6.02 |
-10.21 |
-2.14 |
0 |
|
|
275710 |
103817202 |
1 |
ClN3O3C12H18 |
AB3C3D12E18 |
-86.42 |
5.72 |
-9.6 |
-1.33 |
0 |
|
|
275711 |
103817209 |
1 |
ClON4C10H11 |
ABC4D10E11 |
28.62 |
2.14 |
-10.02 |
-1.72 |
0 |
|
|
275712 |
103817217 |
1 |
ClOF3N3C11H13 |
ABC3D3E11F13 |
-175.01 |
3.88 |
-10.13 |
-1.56 |
0 |
|
|
275713 |
103817221 |
1 |
N3O3C12H17 |
A3B3C12D17 |
-79.26 |
7.29 |
-9.33 |
0.1 |
0 |
|
|
275714 |
103817225 |
1 |
ClN3O4C12H14 |
AB3C4D12E14 |
-65.91 |
4.0 |
-9.93 |
-2.17 |
0 |
|
|
275715 |
103817227 |
1 |
ClON4C15H21 |
ABC4D15E21 |
-14.04 |
5.51 |
-8.81 |
-1.25 |
0 |
|
|
275716 |
103817232 |
1 |
OCl2N4H12C13 |
AB2C4D12E13 |
22.43 |
4.94 |
-9.12 |
-1.46 |
0 |
|
|
275717 |
103817240 |
1 |
BrON3C12H12 |
ABC3D12E12 |
14.7 |
5.88 |
-9.49 |
-0.12 |
0 |
|
|
275718 |
103817247 |
1 |
ClO2N4H11C13 |
AB2C4D11E13 |
24.55 |
1.89 |
-9.82 |
-1.62 |
0 |
|
|
275719 |
103817248 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-68.84 |
5.05 |
-9.56 |
-0.03 |
0 |
|
|
275720 |
103817250 |
1 |
ON4C7H8 |
AB4C7D8 |
23.32 |
7.47 |
-9.8 |
-0.1 |
0 |
|
|
275721 |
103817251 |
1 |
ClO3N4H5C8 |
AB3C4D5E8 |
19.84 |
2.76 |
-11.12 |
-2.38 |
0 |
|
|
275722 |
103817255 |
1 |
ClN3O3C14H16 |
AB3C3D14E16 |
-31.72 |
5.8 |
-9.86 |
-2.06 |
0 |
|
|
275723 |
103817260 |
1 |
ClON3C10H14 |
ABC3D10E14 |
-16.21 |
4.61 |
-9.65 |
-1.3 |
0 |
|
|
275724 |
103817263 |
1 |
ClON3C15H16 |
ABC3D15E16 |
3.32 |
4.5 |
-9.4 |
-1.45 |
0 |
|
|
275725 |
103817268 |
1 |
ClON3C15H20 |
ABC3D15E20 |
-27.33 |
4.62 |
-9.67 |
-1.3 |
0 |
|
|
275726 |
103817269 |
1 |
ClN3O3H12C14 |
AB3C3D12E14 |
5.61 |
4.51 |
-9.24 |
-2.17 |
0 |
|
|
275727 |
103817287 |
1 |
ClON3C12H16 |
ABC3D12E16 |
-20.53 |
4.48 |
-9.64 |
-1.23 |
0 |
|
|
275728 |
103817294 |
1 |
ClOSN4H9C10 |
ABCD4E9F10 |
28.99 |
3.48 |
-9.47 |
-1.63 |
0 |
|
|
275729 |
103817302 |
2 |
ON2C5H6 |
AB2C5D6 |
-12.26 |
7.1 |
-9.51 |
-0.09 |
0 |
|
|
275730 |
103817303 |
1 |
ClN4O4H9C11 |
AB4C4D9E11 |
-17.43 |
6.29 |
-10.25 |
-2.29 |
0 |
|
|
275731 |
103817308 |
1 |
ClN4O4C12H13 |
AB4C4D12E13 |
-62.11 |
4.57 |
-10.18 |
-2.23 |
0 |
|
|
275732 |
103817315 |
2 |
ClON2H4C6 |
ABC2D4E6 |
-23.78 |
5.08 |
-9.63 |
-2.0 |
0 |
|
|
275733 |
103817328 |
1 |
OCl2N3C15H15 |
AB2C3D15E15 |
3.73 |
4.68 |
-9.8 |
-1.27 |
0 |
|
|
275734 |
103817329 |
1 |
ClO3N4C13H13 |
AB3C4D13E13 |
46.82 |
4.71 |
-9.27 |
-2.19 |
0 |
|
|
275735 |
103817331 |
1 |
ClN3O5C12H14 |
AB3C5D12E14 |
-113.82 |
3.71 |
-10.2 |
-2.21 |
0 |
|
|
275736 |
103817332 |
1 |
F2N2O3C13H16 |
A2B2C3D13E16 |
-140.52 |
6.1 |
-10.3 |
-2.05 |
0 |
|
|
275737 |
103817333 |
1 |
ClON2C13H19 |
ABC2D13E19 |
-58.97 |
4.28 |
-9.78 |
-0.74 |
0 |
|
|
275738 |
103817345 |
1 |
ClON4C12H13 |
ABC4D12E13 |
22.93 |
4.74 |
-10.15 |
-1.49 |
0 |
|
|
275739 |
103817349 |
1 |
SO2N3C10H15 |
AB2C3D10E15 |
-43.12 |
7.17 |
-8.55 |
-1.03 |
0 |
|
|
275740 |
103817350 |
1 |
ClSN2O2C12H17 |
ABC2D2E12F17 |
-88.45 |
2.84 |
-8.61 |
-0.78 |
0 |
|
|
275741 |
103817353 |
1 |
ClN3O3C14H18 |
AB3C3D14E18 |
-37.7 |
5.82 |
-9.86 |
-2.06 |
0 |
|
|
275742 |
103817357 |
1 |
ClN3O3C12H14 |
AB3C3D12E14 |
-35.29 |
6.06 |
-9.92 |
-2.07 |
0 |
|
|
275743 |
103817365 |
1 |
ClOSN3C11H16 |
ABCD3E11F16 |
-23.47 |
3.78 |
-8.47 |
-1.55 |
0 |
|
|
275744 |
103817367 |
1 |
O2N3C9H13 |
A2B3C9D13 |
-55.4 |
3.51 |
-9.05 |
0.29 |
0 |
|
|
275745 |
103817373 |
1 |
ClN3O3C10H14 |
AB3C3D10E14 |
-87.93 |
7.31 |
-9.61 |
-1.11 |
0 |
|
|
275746 |
103817375 |
1 |
O2N3C9H11 |
A2B3C9D11 |
-31.35 |
6.38 |
-9.93 |
-1.0 |
0 |
|
|
275747 |
103817384 |
1 |
ON4C11H18 |
AB4C11D18 |
-23.06 |
1.22 |
-8.7 |
0.4 |
0 |
|
|
275748 |
103817386 |
1 |
O2N4C11H18 |
A2B4C11D18 |
-65.1 |
1.01 |
-8.77 |
0.22 |
0 |
|
|
275749 |
103817395 |
1 |
O2N5C11H17 |
A2B5C11D17 |
-56.0 |
3.49 |
-8.9 |
0.11 |
0 |