List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
333831 |
127252383 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-27.13 |
5.44 |
-9.22 |
-0.03 |
0 |
|
|
333832 |
127252384 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-23.3 |
7.49 |
-9.56 |
-0.71 |
0 |
|
|
333833 |
127252385 |
1 |
ON4C15H18 |
AB4C15D18 |
20.64 |
2.5 |
-9.68 |
-0.67 |
0 |
|
|
333834 |
127252386 |
2 |
ON2C8H9 |
AB2C8D9 |
-5.08 |
2.98 |
-9.7 |
-0.68 |
0 |
|
|
333835 |
127252387 |
1 |
O2N5C15H17 |
A2B5C15D17 |
8.83 |
3.77 |
-9.64 |
-1.17 |
0 |
|
|
333836 |
127252388 |
2 |
ON2C8H9 |
AB2C8D9 |
-5.59 |
4.52 |
-9.46 |
-0.67 |
0 |
|
|
333837 |
127252389 |
2 |
ON2C8H9 |
AB2C8D9 |
-8.33 |
3.6 |
-9.36 |
-0.61 |
0 |
|
|
333838 |
127252390 |
1 |
N5C15H21 |
A5B15C21 |
48.74 |
3.01 |
-8.69 |
0.17 |
0 |
|
|
333839 |
127252391 |
1 |
ON4C17H22 |
AB4C17D22 |
6.2 |
4.51 |
-8.91 |
-0.15 |
0 |
|
|
333840 |
127252392 |
1 |
ON5C14H19 |
AB5C14D19 |
28.37 |
2.85 |
-9.67 |
-0.12 |
0 |
|
|
333841 |
127252393 |
1 |
ON5C14H19 |
AB5C14D19 |
27.51 |
3.06 |
-9.39 |
0.18 |
0 |
|
|
333842 |
127252394 |
1 |
OSN3C16H21 |
ABC3D16E21 |
12.68 |
1.54 |
-8.8 |
-0.43 |
0 |
|
|
333843 |
127252395 |
1 |
SO3N4C14H20 |
AB3C4D14E20 |
-53.02 |
4.41 |
-9.58 |
-0.5 |
0 |
|
|
333844 |
127252396 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-12.1 |
2.54 |
-9.31 |
-0.47 |
0 |
|
|
333845 |
127252397 |
1 |
N5C16H23 |
A5B16C23 |
62.55 |
2.39 |
-8.67 |
0.0 |
0 |
|
|
333846 |
127252398 |
1 |
SO2N5C13H19 |
AB2C5D13E19 |
-16.33 |
9.56 |
-9.27 |
-0.07 |
0 |
|
|
333847 |
127252399 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-15.99 |
0.56 |
-8.85 |
-0.41 |
0 |
|
|
333848 |
127252400 |
1 |
SO2N5C12H17 |
AB2C5D12E17 |
-6.43 |
7.51 |
-9.57 |
-0.38 |
0 |
|
|
333849 |
127252401 |
1 |
N2O2C19H22 |
A2B2C19D22 |
-37.62 |
3.38 |
-9.27 |
-0.07 |
0 |
|
|
333850 |
127252402 |
1 |
N2O2C19H24 |
A2B2C19D24 |
-29.71 |
3.19 |
-8.6 |
-0.01 |
0 |
|
|
333851 |
127252403 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-72.55 |
3.88 |
-9.22 |
-0.13 |
0 |
|
|
333852 |
127252404 |
1 |
ON5C17H23 |
AB5C17D23 |
37.97 |
3.24 |
-8.67 |
-0.58 |
0 |
|
|
333853 |
127252405 |
3 |
NOC6H7 |
ABC6D7 |
-59.52 |
4.27 |
-9.24 |
-0.6 |
0 |
|
|
333854 |
127252406 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-66.33 |
1.59 |
-8.71 |
-0.54 |
0 |
|
|
333855 |
127252407 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-60.5 |
6.26 |
-9.02 |
-0.56 |
0 |
|
|
333856 |
127252408 |
1 |
ON6C17H26 |
AB6C17D26 |
34.09 |
1.59 |
-8.75 |
-0.02 |
0 |
|
|
333857 |
127252409 |
1 |
O2N5C17H21 |
A2B5C17D21 |
-16.06 |
6.67 |
-9.32 |
-0.52 |
0 |
|
|
333858 |
127252410 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-15.01 |
7.03 |
-9.1 |
-0.57 |
0 |
|
|
333859 |
127252411 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-14.57 |
5.68 |
-9.14 |
-0.49 |
0 |
|
|
333860 |
127252412 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-20.18 |
5.64 |
-9.58 |
-0.75 |
0 |
|
|
333861 |
127252413 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-5.84 |
3.89 |
-9.76 |
-1.22 |
0 |
|
|
333862 |
127252414 |
1 |
O2N5C16H21 |
A2B5C16D21 |
-14.14 |
1.39 |
-9.71 |
-0.45 |
0 |
|
|
333863 |
127252415 |
1 |
O2N5C16H21 |
A2B5C16D21 |
-24.99 |
5.65 |
-9.57 |
-0.36 |
0 |
|
|
333864 |
127252416 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-113.0 |
5.31 |
-9.45 |
-0.28 |
0 |
|
|
333865 |
127252417 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-35.02 |
4.6 |
-9.28 |
-0.27 |
0 |
|
|
333866 |
127252418 |
1 |
FO2N3C19H22 |
AB2C3D19E22 |
-88.97 |
2.06 |
-9.61 |
-0.4 |
0 |
|
|
333867 |
127252419 |
1 |
F3N3C12H16 |
A3B3C12D16 |
-136.12 |
3.22 |
-8.78 |
-0.89 |
0 |
|
|
333868 |
127252420 |
1 |
OF3N3C13H16 |
AB3C3D13E16 |
-184.81 |
7.57 |
-9.37 |
-1.31 |
0 |
|
|
333869 |
127252421 |
1 |
OF3N3C14H18 |
AB3C3D14E18 |
-188.61 |
6.65 |
-9.41 |
-1.31 |
0 |
|
|
333870 |
127252422 |
2 |
ON2C6H9 |
AB2C6D9 |
-71.79 |
7.6 |
-9.64 |
-0.1 |
0 |
|
|
333871 |
127252423 |
1 |
OF3N4C14H19 |
AB3C4D14E19 |
-178.03 |
6.81 |
-8.95 |
-1.36 |
0 |
|
|
333872 |
127252424 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-72.73 |
4.49 |
-9.2 |
-0.44 |
0 |
|
|
333873 |
127252425 |
1 |
N5C14H17 |
A5B14C17 |
71.23 |
4.41 |
-8.48 |
-0.6 |
0 |
|
|
333874 |
127252426 |
2 |
N3C7H9 |
A3B7C9 |
65.07 |
4.05 |
-8.43 |
-0.28 |
0 |
|
|
333875 |
127252427 |
1 |
ON6C17H22 |
AB6C17D22 |
31.19 |
0.65 |
-8.74 |
-0.84 |
0 |
|
|
333876 |
127252428 |
1 |
N5C14H17 |
A5B14C17 |
68.41 |
2.82 |
-8.59 |
-0.33 |
0 |
|
|
333877 |
127252429 |
1 |
N6C15H20 |
A6B15C20 |
62.82 |
3.84 |
-8.58 |
0.03 |
0 |
|
|
333878 |
127252430 |
1 |
F3N5C15H16 |
A3B5C15D16 |
-89.14 |
3.35 |
-8.76 |
-0.97 |
0 |
|
|
333879 |
127252431 |
1 |
ON3C17H25 |
AB3C17D25 |
-46.94 |
5.49 |
-9.11 |
-0.46 |
0 |
|
|
333880 |
127252432 |
1 |
OSN4C15H20 |
ABC4D15E20 |
-2.0 |
9.54 |
-9.35 |
-0.65 |
0 |