List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
294100 |
117427122 |
1 |
ClFNO3H9C12 |
ABCD3E9F12 |
-97.05 |
3.57 |
-9.9 |
-1.57 |
0 |
|
|
294101 |
117427129 |
1 |
ClFO2N3H9C11 |
ABC2D3E9F11 |
-51.28 |
1.58 |
-8.93 |
-0.75 |
0 |
|
|
294102 |
117427147 |
1 |
ClNO4C12H12 |
ABC4D12E12 |
-112.38 |
6.61 |
-9.06 |
-1.02 |
0 |
|
|
294103 |
117427152 |
1 |
ClNO4C12H12 |
ABC4D12E12 |
-131.68 |
4.61 |
-9.29 |
-0.84 |
0 |
|
|
294104 |
117427157 |
1 |
ClNO4C12H12 |
ABC4D12E12 |
-137.31 |
3.77 |
-9.02 |
-0.51 |
0 |
|
|
294105 |
117427167 |
1 |
ClNO4C12H12 |
ABC4D12E12 |
-128.46 |
6.31 |
-8.84 |
-1.5 |
0 |
|
|
294106 |
117427180 |
1 |
ClN3O3C11H12 |
AB3C3D11E12 |
-29.93 |
3.99 |
-8.76 |
-0.77 |
0 |
|
|
294107 |
117427188 |
1 |
ClN3O3C11H12 |
AB3C3D11E12 |
-27.06 |
3.82 |
-8.57 |
-1.6 |
0 |
|
|
294108 |
117427193 |
1 |
ClN3O3C11H12 |
AB3C3D11E12 |
-33.99 |
5.77 |
-8.28 |
-1.84 |
0 |
|
|
294109 |
117427194 |
1 |
ClN3O3C11H12 |
AB3C3D11E12 |
-23.2 |
3.75 |
-8.82 |
-0.94 |
0 |
|
|
294110 |
117427206 |
1 |
ClNSO3H8C11 |
ABCD3E8F11 |
-37.0 |
5.54 |
-9.07 |
-1.29 |
0 |
|
|
294111 |
117427220 |
1 |
ClFON3C12H13 |
ABCD3E12F13 |
-32.75 |
1.67 |
-8.81 |
-0.32 |
0 |
|
|
294112 |
117427228 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-105.15 |
3.88 |
-9.27 |
-0.56 |
0 |
|
|
294113 |
117427235 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-100.91 |
4.71 |
-9.44 |
-0.68 |
0 |
|
|
294114 |
117427240 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-103.68 |
4.72 |
-9.3 |
-0.77 |
0 |
|
|
294115 |
117427243 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-105.97 |
4.89 |
-9.21 |
-0.54 |
0 |
|
|
294116 |
117427246 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-92.27 |
5.7 |
-9.7 |
-0.63 |
0 |
|
|
294117 |
117427247 |
1 |
ClFNO2C13H13 |
ABCD2E13F13 |
-92.74 |
3.57 |
-9.71 |
-0.66 |
0 |
|
|
294118 |
117427276 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-79.95 |
2.72 |
-8.63 |
-0.37 |
0 |
|
|
294119 |
117427282 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-103.24 |
3.37 |
-8.78 |
-0.22 |
0 |
|
|
294120 |
117427305 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-77.66 |
3.33 |
-8.65 |
-0.32 |
0 |
|
|
294121 |
117427314 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-126.61 |
3.92 |
-8.62 |
0.01 |
0 |
|
|
294122 |
117427321 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-102.91 |
3.44 |
-9.18 |
-0.27 |
0 |
|
|
294123 |
117427324 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-132.89 |
6.06 |
-8.89 |
-0.3 |
0 |
|
|
294124 |
117427325 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-136.26 |
7.71 |
-8.93 |
-0.27 |
0 |
|
|
294125 |
117427363 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-140.73 |
5.75 |
-9.01 |
-0.26 |
0 |
|
|
294126 |
117427373 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-109.73 |
1.47 |
-8.65 |
-0.48 |
0 |
|
|
294127 |
117427378 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-109.73 |
3.48 |
-8.99 |
-0.47 |
0 |
|
|
294128 |
117427386 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-119.7 |
3.82 |
-9.12 |
-0.62 |
0 |
|
|
294129 |
117427399 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-123.42 |
6.17 |
-9.07 |
-0.3 |
0 |
|
|
294130 |
117427405 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-122.11 |
4.33 |
-8.86 |
-0.16 |
0 |
|
|
294131 |
117427455 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-101.15 |
4.08 |
-8.98 |
-0.45 |
0 |
|
|
294132 |
117427476 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-92.66 |
5.53 |
-8.97 |
-0.79 |
0 |
|
|
294133 |
117427479 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-105.39 |
5.39 |
-9.33 |
-0.91 |
0 |
|
|
294134 |
117427485 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-114.81 |
5.69 |
-9.0 |
-0.41 |
0 |
|
|
294135 |
117427487 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-57.12 |
3.8 |
-8.79 |
-0.19 |
0 |
|
|
294136 |
117427506 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-108.88 |
2.41 |
-8.65 |
-0.55 |
0 |
|
|
294137 |
117427528 |
1 |
ClNO3C13H16 |
ABC3D13E16 |
-89.31 |
5.77 |
-9.13 |
-0.89 |
0 |
|
|
294138 |
117427560 |
1 |
ClOSN3C11H12 |
ABCD3E11F12 |
20.27 |
4.39 |
-8.66 |
-0.71 |
0 |
|
|
294139 |
117427612 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-77.63 |
0.83 |
-8.72 |
-0.1 |
0 |
|
|
294140 |
117427670 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-70.52 |
2.62 |
-8.5 |
-0.12 |
0 |
|
|
294141 |
117427676 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-78.49 |
3.11 |
-8.3 |
-0.02 |
0 |
|
|
294142 |
117427683 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-73.33 |
5.51 |
-8.51 |
-0.13 |
0 |
|
|
294143 |
117427717 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-61.77 |
2.54 |
-8.72 |
-0.1 |
0 |
|
|
294144 |
117427770 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-78.44 |
4.78 |
-8.38 |
-0.07 |
0 |
|
|
294145 |
117427830 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-81.02 |
5.13 |
-8.32 |
-0.02 |
0 |
|
|
294146 |
117427846 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-88.07 |
5.31 |
-8.53 |
-0.09 |
0 |
|
|
294147 |
117427898 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-83.89 |
0.73 |
-8.57 |
-0.06 |
0 |
|
|
294148 |
117428183 |
1 |
BrFNOH9C11 |
ABCDE9F11 |
-48.61 |
3.8 |
-9.07 |
-0.6 |
0 |
|
|
294149 |
117428184 |
1 |
BrFNOH9C11 |
ABCDE9F11 |
-48.68 |
2.66 |
-9.05 |
-0.65 |
0 |