List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275650 |
103816889 |
1 |
SN2O2C16H16 |
AB2C2D16E16 |
-31.17 |
2.86 |
-9.35 |
-0.9 |
0 |
|
|
275651 |
103816896 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-136.21 |
4.24 |
-9.41 |
0.07 |
0 |
|
|
275652 |
103816897 |
1 |
SN2O2C14H14 |
AB2C2D14E14 |
-36.42 |
4.32 |
-9.3 |
-0.89 |
0 |
|
|
275653 |
103816901 |
1 |
O2N5C12H13 |
A2B5C12D13 |
16.96 |
6.52 |
-9.66 |
-0.55 |
0 |
|
|
275654 |
103816907 |
1 |
NO2C15H17 |
AB2C15D17 |
-59.66 |
2.44 |
-9.5 |
0.01 |
0 |
|
|
275655 |
103816909 |
1 |
NO2C14H17 |
AB2C14D17 |
-74.22 |
2.74 |
-9.3 |
0.18 |
0 |
|
|
275656 |
103816918 |
1 |
FN2O2H13C15 |
AB2C2D13E15 |
-74.21 |
4.8 |
-9.51 |
-0.96 |
0 |
|
|
275657 |
103816920 |
1 |
NO3C13H17 |
AB3C13D17 |
-119.78 |
1.93 |
-9.46 |
0.06 |
0 |
|
|
275658 |
103816923 |
2 |
ClNOH6C7 |
ABCD6E7 |
-52.5 |
2.64 |
-9.29 |
-0.51 |
0 |
|
|
275659 |
103816928 |
1 |
NO3C15H19 |
AB3C15D19 |
-125.61 |
2.72 |
-9.47 |
0.06 |
0 |
|
|
275660 |
103816931 |
1 |
NO3C14H19 |
AB3C14D19 |
-123.76 |
0.82 |
-9.44 |
0.12 |
0 |
|
|
275661 |
103816951 |
1 |
NSO4C13H17 |
ABC4D13E17 |
-164.79 |
3.37 |
-9.6 |
-0.1 |
0 |
|
|
275662 |
103816959 |
1 |
NO3C15H19 |
AB3C15D19 |
-122.74 |
4.29 |
-9.62 |
-0.13 |
0 |
|
|
275663 |
103816964 |
1 |
NO3C16H21 |
AB3C16D21 |
-130.85 |
2.53 |
-9.37 |
0.18 |
0 |
|
|
275664 |
103816970 |
1 |
BrNO3C13H18 |
ABC3D13E18 |
-124.21 |
4.18 |
-8.98 |
-0.17 |
0 |
|
|
275665 |
103816972 |
1 |
BrN2O2C15H15 |
AB2C2D15E15 |
-54.93 |
4.59 |
-9.22 |
-0.83 |
0 |
|
|
275666 |
103816973 |
1 |
BrON3C14H14 |
ABC3D14E14 |
3.26 |
3.22 |
-9.15 |
-1.06 |
0 |
|
|
275667 |
103816984 |
1 |
ClO3N4C13H17 |
AB3C4D13E17 |
-21.14 |
4.93 |
-9.05 |
-2.1 |
0 |
|
|
275668 |
103816986 |
1 |
ClN3O3H10C13 |
AB3C3D10E13 |
16.13 |
4.29 |
-9.33 |
-2.19 |
0 |
|
|
275669 |
103817001 |
1 |
ClOF3N3H7C12 |
ABC3D3E7F12 |
-133.82 |
6.35 |
-9.53 |
-1.91 |
0 |
|
|
275670 |
103817004 |
1 |
ClN3O3H10C13 |
AB3C3D10E13 |
-57.44 |
5.28 |
-9.48 |
-1.93 |
0 |
|
|
275671 |
103817005 |
1 |
ClFN3O3H7C12 |
ABC3D3E7F12 |
-32.47 |
3.84 |
-9.47 |
-2.31 |
0 |
|
|
275672 |
103817010 |
1 |
ClO2N4H9C12 |
AB2C4D9E12 |
-15.03 |
3.71 |
-9.43 |
-1.91 |
0 |
|
|
275673 |
103817016 |
1 |
ClF2N3O3H6C12 |
AB2C3D3E6F12 |
-79.08 |
2.7 |
-9.62 |
-2.38 |
0 |
|
|
275674 |
103817019 |
1 |
ClO2N3H10C13 |
AB2C3D10E13 |
-13.43 |
5.05 |
-9.33 |
-1.87 |
0 |
|
|
275675 |
103817021 |
1 |
BrClFN3O3H6C12 |
ABCD3E3F6G12 |
-29.31 |
2.51 |
-9.54 |
-2.41 |
0 |
|
|
275676 |
103817022 |
1 |
BrClFON3H6C11 |
ABCDE3F6G11 |
-13.81 |
2.48 |
-9.33 |
-1.9 |
0 |
|
|
275677 |
103817023 |
1 |
ClF2N3O3H6C12 |
AB2C3D3E6F12 |
-78.44 |
4.57 |
-9.62 |
-2.45 |
0 |
|
|
275678 |
103817035 |
1 |
ClION3H7C11 |
ABCD3E7F11 |
44.43 |
2.23 |
-9.31 |
-1.84 |
0 |
|
|
275679 |
103817042 |
1 |
BrClOF3N3H6C12 |
ABCD3E3F6G12 |
-126.43 |
6.84 |
-9.54 |
-2.01 |
0 |
|
|
275680 |
103817049 |
1 |
BrON3C13H14 |
ABC3D13E14 |
19.04 |
6.21 |
-9.14 |
0.0 |
0 |
|
|
275681 |
103817053 |
1 |
ClO2N4C9H11 |
AB2C4D9E11 |
-53.14 |
1.68 |
-9.87 |
-1.6 |
0 |
|
|
275682 |
103817054 |
1 |
ClN4O4C12H13 |
AB4C4D12E13 |
-68.52 |
2.43 |
-10.21 |
-2.25 |
0 |
|
|
275683 |
103817059 |
1 |
ClO2N4C13H17 |
AB2C4D13E17 |
-49.82 |
7.19 |
-9.57 |
-1.29 |
0 |
|
|
275684 |
103817062 |
1 |
ClN4O4C11H13 |
AB4C4D11E13 |
-55.43 |
5.34 |
-9.66 |
-2.08 |
0 |
|
|
275685 |
103817073 |
1 |
ClO2N4H9C12 |
AB2C4D9E12 |
-13.89 |
5.49 |
-9.4 |
-1.92 |
0 |
|
|
275686 |
103817078 |
1 |
ClON5C11H12 |
ABC5D11E12 |
29.84 |
2.53 |
-8.79 |
-1.53 |
0 |
|
|
275687 |
103817086 |
1 |
ClON3C14H14 |
ABC3D14E14 |
22.25 |
4.29 |
-9.68 |
-1.39 |
0 |
|
|
275688 |
103817102 |
1 |
ClON3C10H14 |
ABC3D10E14 |
-27.48 |
4.14 |
-10.05 |
-1.43 |
0 |
|
|
275689 |
103817105 |
1 |
ClON3C13H18 |
ABC3D13E18 |
-19.52 |
4.63 |
-9.61 |
-1.31 |
0 |
|
|
275690 |
103817106 |
1 |
ClON3C15H18 |
ABC3D15E18 |
-30.55 |
4.02 |
-9.9 |
-1.44 |
0 |
|
|
275691 |
103817109 |
1 |
ClN3O3C8H8 |
AB3C3D8E8 |
-82.12 |
3.1 |
-10.34 |
-1.63 |
0 |
|
|
275692 |
103817112 |
1 |
ClON6H11C13 |
ABC6D11E13 |
69.15 |
2.59 |
-9.28 |
-1.76 |
0 |
|
|
275693 |
103817116 |
1 |
ClON3C12H16 |
ABC3D12E16 |
4.25 |
4.22 |
-9.64 |
-1.31 |
0 |
|
|
275694 |
103817134 |
1 |
ClO2N4C11H15 |
AB2C4D11E15 |
-41.02 |
2.85 |
-9.28 |
-1.52 |
0 |
|
|
275695 |
103817142 |
1 |
ClON3C11H14 |
ABC3D11E14 |
3.85 |
4.18 |
-9.66 |
-1.39 |
0 |
|
|
275696 |
103817144 |
1 |
ClON4C14H15 |
ABC4D14E15 |
25.54 |
1.71 |
-8.8 |
-1.7 |
0 |
|
|
275697 |
103817154 |
1 |
Cl2N3O3H9C13 |
A2B3C3D9E13 |
-52.77 |
2.21 |
-8.66 |
-1.73 |
0 |
|
|
275698 |
103817155 |
1 |
ClN4O4C12H15 |
AB4C4D12E15 |
-72.34 |
5.46 |
-10.22 |
-2.17 |
0 |
|
|
275699 |
103817161 |
1 |
ClN4O4C12H15 |
AB4C4D12E15 |
-80.88 |
5.36 |
-10.13 |
-2.24 |
0 |