List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
254125 |
103122866 |
1 |
ClON4C11H13 |
ABC4D11E13 |
6.81 |
0.93 |
-9.66 |
-1.29 |
0 |
|
|
254126 |
103122870 |
1 |
BrON3C13H16 |
ABC3D13E16 |
-3.54 |
3.28 |
-8.91 |
-0.53 |
0 |
|
|
254127 |
103122885 |
1 |
ClON3C10H16 |
ABC3D10E16 |
-34.55 |
4.29 |
-9.7 |
0.05 |
0 |
|
|
254128 |
103122888 |
1 |
BrON3C10H16 |
ABC3D10E16 |
-25.27 |
3.87 |
-9.72 |
-0.13 |
0 |
|
|
254129 |
103122892 |
1 |
BrON4C12H15 |
ABC4D12E15 |
14.08 |
2.21 |
-9.66 |
-1.28 |
0 |
|
|
254130 |
103122900 |
1 |
BrON3C10H16 |
ABC3D10E16 |
-14.38 |
6.95 |
-9.28 |
0.01 |
0 |
|
|
254131 |
103122909 |
1 |
ClON3C12H12 |
ABC3D12E12 |
26.11 |
1.98 |
-9.28 |
-0.93 |
0 |
|
|
254132 |
103122919 |
1 |
BrON3C10H16 |
ABC3D10E16 |
-27.09 |
7.6 |
-9.72 |
-0.02 |
0 |
|
|
254133 |
103122927 |
1 |
ClO2N3C10H14 |
AB2C3D10E14 |
-50.64 |
7.92 |
-9.39 |
0.06 |
0 |
|
|
254134 |
103122938 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-13.95 |
7.35 |
-9.44 |
0.12 |
0 |
|
|
254135 |
103122958 |
1 |
ClO2N3C12H18 |
AB2C3D12E18 |
-67.31 |
3.46 |
-9.12 |
0.11 |
0 |
|
|
254136 |
103122992 |
1 |
BrON3C15H18 |
ABC3D15E18 |
21.21 |
2.36 |
-9.19 |
-0.94 |
0 |
|
|
254137 |
103122993 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-2.77 |
4.98 |
-9.32 |
-0.06 |
0 |
|
|
254138 |
103123002 |
1 |
BrON3C14H16 |
ABC3D14E16 |
22.87 |
3.9 |
-9.05 |
-0.74 |
0 |
|
|
254139 |
103123005 |
1 |
ClO2N4C13H15 |
AB2C4D13E15 |
-21.5 |
3.53 |
-9.43 |
-1.35 |
0 |
|
|
254140 |
103123017 |
1 |
ClON3C14H16 |
ABC3D14E16 |
-3.35 |
4.43 |
-9.02 |
-0.69 |
0 |
|
|
254141 |
103123043 |
1 |
O2N5C13H23 |
A2B5C13D23 |
-45.14 |
6.99 |
-9.17 |
-0.38 |
0 |
|
|
254142 |
103123049 |
1 |
ON5C11H15 |
AB5C11D15 |
31.4 |
3.36 |
-9.19 |
-1.19 |
0 |
|
|
254143 |
103123052 |
1 |
ON4C16H16 |
AB4C16D16 |
47.81 |
2.06 |
-9.09 |
-0.78 |
0 |
|
|
254144 |
103123055 |
1 |
ON4C14H18 |
AB4C14D18 |
15.86 |
5.92 |
-9.15 |
-0.02 |
0 |
|
|
254145 |
103123059 |
2 |
ON2C5H9 |
AB2C5D9 |
-40.2 |
8.3 |
-9.08 |
0.22 |
0 |
|
|
254146 |
103123062 |
1 |
ON5C14H21 |
AB5C14D21 |
16.59 |
4.42 |
-9.28 |
-0.98 |
0 |
|
|
254147 |
103123078 |
1 |
O3N6C12H16 |
A3B6C12D16 |
-19.41 |
3.54 |
-9.5 |
-1.02 |
0 |
|
|
254148 |
103123082 |
1 |
O2N6C13H18 |
A2B6C13D18 |
-4.26 |
5.57 |
-9.13 |
-0.59 |
0 |
|
|
254149 |
103123091 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-78.08 |
6.06 |
-9.47 |
-0.76 |
0 |
|
|
254150 |
103123094 |
1 |
ON4C10H18 |
AB4C10D18 |
-19.67 |
4.94 |
-9.18 |
0.17 |
0 |
|
|
254151 |
103123096 |
1 |
ON4C16H22 |
AB4C16D22 |
-2.78 |
6.47 |
-8.9 |
-0.54 |
0 |
|
|
254152 |
103123098 |
1 |
F3O3N4C11H15 |
A3B3C4D11E15 |
-246.8 |
5.9 |
-9.5 |
-0.78 |
0 |
|
|
254153 |
103123108 |
1 |
ON4C12H20 |
AB4C12D20 |
-16.78 |
5.87 |
-9.25 |
0.14 |
0 |
|
|
254154 |
103123113 |
1 |
ON4C13H22 |
AB4C13D22 |
-21.57 |
6.42 |
-9.16 |
0.46 |
0 |
|
|
254155 |
103123130 |
1 |
ON5C13H17 |
AB5C13D17 |
38.85 |
4.9 |
-9.41 |
-1.11 |
0 |
|
|
254156 |
103123139 |
1 |
ON4C10H16 |
AB4C10D16 |
-0.11 |
4.46 |
-9.4 |
0.12 |
0 |
|
|
254157 |
103123140 |
1 |
ON4C15H20 |
AB4C15D20 |
21.35 |
3.9 |
-8.8 |
-0.43 |
0 |
|
|
254158 |
103123159 |
2 |
ON2C7H9 |
AB2C7D9 |
-22.64 |
2.87 |
-9.13 |
-0.96 |
0 |
|
|
254159 |
103123165 |
1 |
ON4C14H18 |
AB4C14D18 |
32.26 |
6.2 |
-8.96 |
-0.57 |
0 |
|
|
254160 |
103123170 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-90.48 |
7.22 |
-9.29 |
-0.57 |
0 |
|
|
254161 |
103123188 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
-12.97 |
6.42 |
-9.35 |
-0.66 |
0 |
|
|
254162 |
103123192 |
1 |
ON5C12H17 |
AB5C12D17 |
27.17 |
2.63 |
-9.27 |
-1.17 |
0 |
|
|
254163 |
103123196 |
1 |
ON4C14H20 |
AB4C14D20 |
0.94 |
5.89 |
-8.93 |
-0.55 |
0 |
|
|
254164 |
103123202 |
1 |
ON4C10H18 |
AB4C10D18 |
-19.46 |
6.78 |
-9.02 |
0.0 |
0 |
|
|
254165 |
103123208 |
1 |
SO2F3N4C11H15 |
AB2C3D4E11F15 |
-199.12 |
5.78 |
-9.43 |
-1.59 |
0 |
|
|
254166 |
103123211 |
1 |
ON4C10H18 |
AB4C10D18 |
-11.25 |
6.8 |
-9.09 |
0.25 |
0 |
|
|
254167 |
103123215 |
1 |
ON5C11H13 |
AB5C11D13 |
55.86 |
2.93 |
-9.48 |
-1.14 |
0 |
|
|
254168 |
103123216 |
1 |
ON4C9H14 |
AB4C9D14 |
18.15 |
6.05 |
-9.2 |
-0.01 |
0 |
|
|
254169 |
103123218 |
1 |
ON5C12H17 |
AB5C12D17 |
14.67 |
4.42 |
-9.16 |
-1.22 |
0 |
|
|
254170 |
103123220 |
1 |
ON4C14H18 |
AB4C14D18 |
18.8 |
4.71 |
-8.93 |
-0.55 |
0 |
|
|
254171 |
103123224 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-13.38 |
6.28 |
-9.18 |
-1.05 |
0 |
|
|
254172 |
103123233 |
1 |
ON5C13H17 |
AB5C13D17 |
27.28 |
3.15 |
-9.36 |
-1.24 |
0 |
|
|
254173 |
103123245 |
1 |
ON4C14H18 |
AB4C14D18 |
20.33 |
5.09 |
-9.24 |
0.1 |
0 |
|
|
254174 |
103123248 |
1 |
ON5C14H19 |
AB5C14D19 |
24.59 |
3.9 |
-9.24 |
-1.19 |
0 |
|
|
254175 |
103123253 |
1 |
ON4C11H18 |
AB4C11D18 |
-9.68 |
5.32 |
-9.02 |
0.27 |
0 |
|
|
254176 |
103123256 |
1 |
ON5C14H19 |
AB5C14D19 |
40.57 |
4.05 |
-9.35 |
-1.21 |
0 |
|
|
254177 |
103123261 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-12.39 |
8.13 |
-9.26 |
-0.68 |
0 |
|
|
254178 |
103123264 |
2 |
ON2C7H9 |
AB2C7D9 |
-23.9 |
4.51 |
-9.05 |
-0.91 |
0 |
|
|
254179 |
103123265 |
1 |
O2N5C13H17 |
A2B5C13D17 |
-8.94 |
3.83 |
-9.27 |
-1.26 |
0 |
|
|
254180 |
103123268 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-55.3 |
7.06 |
-9.13 |
-0.5 |
0 |
|
|
254181 |
103123270 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-57.73 |
7.19 |
-9.08 |
-0.49 |
0 |
|
|
254182 |
103123274 |
2 |
ON2C3H4 |
AB2C3D4 |
-46.83 |
6.45 |
-10.26 |
-0.48 |
0 |
|
|
254183 |
103123277 |
2 |
ON2C5H5 |
AB2C5D5 |
-29.06 |
6.25 |
-9.26 |
-0.95 |
0 |
|
|
254184 |
103123278 |
1 |
O3N6C12H16 |
A3B6C12D16 |
10.0 |
4.69 |
-9.36 |
-1.07 |
0 |
|
|
254185 |
103123283 |
1 |
O2N3H7C10 |
A2B3C7D10 |
53.87 |
2.85 |
-9.55 |
-1.48 |
0 |
|
|
254186 |
103123285 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-58.73 |
8.78 |
-9.05 |
-0.47 |
0 |
|
|
254187 |
103123289 |
2 |
ON2C7H12 |
AB2C7D12 |
-60.32 |
6.93 |
-9.11 |
-0.49 |
0 |
|
|
254188 |
103123290 |
1 |
SO2N4C12H20 |
AB2C4D12E20 |
-42.72 |
6.86 |
-9.24 |
-0.59 |
0 |
|
|
254189 |
103123292 |
1 |
SO2N4C11H18 |
AB2C4D11E18 |
-35.23 |
5.42 |
-8.88 |
-0.67 |
0 |
|
|
254190 |
103123294 |
1 |
O3N4C14H24 |
A3B4C14D24 |
-109.34 |
6.57 |
-9.13 |
-0.43 |
0 |
|
|
254191 |
103123297 |
1 |
O2N4C11H18 |
A2B4C11D18 |
-48.41 |
6.83 |
-9.11 |
-0.49 |
0 |
|
|
254192 |
103123299 |
1 |
N5H11C16 |
A5B11C16 |
170.41 |
12.34 |
-8.51 |
-2.0 |
0 |
|
|
254193 |
103123314 |
1 |
N5H9C12 |
A5B9C12 |
159.11 |
10.3 |
-8.38 |
-1.86 |
0 |
|
|
254194 |
103123321 |
1 |
N5C12H13 |
A5B12C13 |
127.69 |
8.03 |
-8.05 |
-1.54 |
0 |
|
|
254195 |
103123322 |
2 |
N3H6C7 |
A3B6C7 |
128.57 |
1.64 |
-8.67 |
-1.17 |
0 |
|
|
254196 |
103123342 |
1 |
N5H15C16 |
A5B15C16 |
115.05 |
0.58 |
-8.28 |
-0.75 |
0 |
|
|
254197 |
103123344 |
1 |
N5C13H15 |
A5B13C15 |
91.9 |
4.21 |
-8.43 |
-0.25 |
0 |
|
|
254198 |
103123348 |
1 |
N5H13C15 |
A5B13C15 |
113.88 |
3.23 |
-8.48 |
-0.92 |
0 |
|
|
254199 |
103123354 |
1 |
O2F3N4C12H17 |
A2B3C4D12E17 |
-210.96 |
5.73 |
-9.44 |
-0.68 |
0 |