List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
248250 |
103080022 |
1 |
O2N4C13H24 |
A2B4C13D24 |
-10.69 |
6.21 |
-8.79 |
-0.65 |
0 |
|
|
248251 |
103080028 |
1 |
O3N4C8H12 |
A3B4C8D12 |
-12.57 |
6.04 |
-9.15 |
-0.85 |
0 |
|
|
248252 |
103080035 |
1 |
O2N5C12H19 |
A2B5C12D19 |
22.77 |
6.07 |
-8.69 |
-0.74 |
0 |
|
|
248253 |
103080037 |
1 |
O3N5C10H17 |
A3B5C10D17 |
-33.62 |
7.04 |
-9.31 |
-0.97 |
0 |
|
|
248254 |
103080044 |
2 |
N2O2C4H7 |
A2B2C4D7 |
-68.82 |
8.39 |
-9.13 |
-0.79 |
0 |
|
|
248255 |
103080057 |
1 |
O3N6C9H16 |
A3B6C9D16 |
-13.1 |
3.25 |
-9.06 |
-0.82 |
0 |
|
|
248256 |
103080063 |
2 |
ON2C7H12 |
AB2C7D12 |
-15.36 |
6.56 |
-8.8 |
-0.62 |
0 |
|
|
248257 |
103080070 |
1 |
O3N5C10H17 |
A3B5C10D17 |
-31.69 |
5.29 |
-9.35 |
-0.98 |
0 |
|
|
248258 |
103080072 |
1 |
O3N5C11H19 |
A3B5C11D19 |
-41.36 |
8.58 |
-9.1 |
-0.89 |
0 |
|
|
248259 |
103080079 |
1 |
O3N5C9H15 |
A3B5C9D15 |
-24.4 |
5.21 |
-8.97 |
-0.74 |
0 |
|
|
248260 |
103080101 |
2 |
ON2C4H6 |
AB2C4D6 |
42.77 |
6.26 |
-8.96 |
-0.72 |
0 |
|
|
248261 |
103080106 |
1 |
O2N4C9H16 |
A2B4C9D16 |
4.5 |
6.55 |
-8.76 |
-0.59 |
0 |
|
|
248262 |
103080111 |
1 |
O2N4C9H12 |
A2B4C9D12 |
44.29 |
6.16 |
-8.88 |
-0.69 |
0 |
|
|
248263 |
103080113 |
1 |
SO2N4C9H16 |
AB2C4D9E16 |
16.23 |
4.79 |
-8.6 |
-0.73 |
0 |
|
|
248264 |
103080115 |
1 |
O2N4C9H12 |
A2B4C9D12 |
62.28 |
6.94 |
-8.98 |
-0.71 |
0 |
|
|
248265 |
103080116 |
2 |
ON2C5H8 |
AB2C5D8 |
25.57 |
6.28 |
-8.83 |
-0.65 |
0 |
|
|
248266 |
103080117 |
1 |
SO2N4C9H16 |
AB2C4D9E16 |
11.77 |
7.59 |
-8.76 |
-0.65 |
0 |
|
|
248267 |
103080123 |
1 |
SO3N4C8H14 |
AB3C4D8E14 |
-2.63 |
8.67 |
-8.25 |
-0.97 |
0 |
|
|
248268 |
103080128 |
1 |
SO3N4C8H14 |
AB3C4D8E14 |
-1.26 |
8.41 |
-8.48 |
-0.7 |
0 |
|
|
248269 |
103080135 |
1 |
SO3N4C9H16 |
AB3C4D9E16 |
-10.03 |
9.82 |
-8.45 |
-0.74 |
0 |
|
|
248270 |
103080145 |
1 |
SO2N4C9H14 |
AB2C4D9E14 |
20.28 |
6.72 |
-8.74 |
-0.8 |
0 |
|
|
248271 |
103080146 |
2 |
ON2C5H8 |
AB2C5D8 |
22.73 |
6.42 |
-8.92 |
-0.69 |
0 |
|
|
248272 |
103080158 |
2 |
ON2C5H8 |
AB2C5D8 |
35.49 |
6.35 |
-8.85 |
-0.66 |
0 |
|
|
248273 |
103080162 |
1 |
O3N4C11H12 |
A3B4C11D12 |
12.56 |
6.18 |
-8.89 |
-0.67 |
0 |
|
|
248274 |
103080163 |
1 |
O3N4C11H12 |
A3B4C11D12 |
13.06 |
5.85 |
-8.84 |
-0.62 |
0 |
|
|
248275 |
103080168 |
1 |
O4N5C12H21 |
A4B5C12D21 |
-88.02 |
4.23 |
-9.06 |
-0.8 |
0 |
|
|
248276 |
103080171 |
2 |
ON2C5H8 |
AB2C5D8 |
9.78 |
6.46 |
-8.88 |
-0.68 |
0 |
|
|
248277 |
103080176 |
1 |
O3N4C13H16 |
A3B4C13D16 |
7.03 |
6.32 |
-9.09 |
-0.81 |
0 |
|
|
248278 |
103080188 |
1 |
ClSO2N3C6H8 |
ABC2D3E6F8 |
20.27 |
6.45 |
-9.08 |
-1.11 |
0 |
|
|
248279 |
103080190 |
1 |
ClSO2N3C8H12 |
ABC2D3E8F12 |
7.59 |
5.42 |
-8.86 |
-0.89 |
0 |
|
|
248280 |
103080205 |
1 |
O2N5C12H19 |
A2B5C12D19 |
21.31 |
7.12 |
-8.73 |
-0.64 |
0 |
|
|
248281 |
103080230 |
1 |
O2N5C13H17 |
A2B5C13D17 |
51.08 |
6.99 |
-8.78 |
-0.61 |
0 |
|
|
248282 |
103080253 |
1 |
O3N6C12H20 |
A3B6C12D20 |
-14.9 |
7.36 |
-8.92 |
-0.71 |
0 |
|
|
248283 |
103080254 |
1 |
O2N5C13H21 |
A2B5C13D21 |
20.92 |
8.2 |
-8.75 |
-0.71 |
0 |
|
|
248284 |
103080265 |
1 |
O2N5C10H17 |
A2B5C10D17 |
22.74 |
6.66 |
-8.91 |
-0.72 |
0 |
|
|
248285 |
103080267 |
1 |
O2N5C12H21 |
A2B5C12D21 |
21.57 |
5.96 |
-8.68 |
-0.72 |
0 |
|
|
248286 |
103080273 |
1 |
O3N5C12H21 |
A3B5C12D21 |
-26.28 |
7.32 |
-9.03 |
-0.78 |
0 |
|
|
248287 |
103080287 |
1 |
O2N5C9H15 |
A2B5C9D15 |
46.51 |
7.6 |
-8.9 |
-0.71 |
0 |
|
|
248288 |
103080317 |
1 |
O2N5C12H21 |
A2B5C12D21 |
15.29 |
6.91 |
-8.65 |
-0.63 |
0 |
|
|
248289 |
103080331 |
2 |
ON3C5H9 |
AB3C5D9 |
39.13 |
5.9 |
-8.46 |
-0.78 |
0 |
|
|
248290 |
103080333 |
1 |
O2N5C12H21 |
A2B5C12D21 |
22.47 |
6.65 |
-8.74 |
-0.66 |
0 |
|
|
248291 |
103080335 |
1 |
O2N5C13H15 |
A2B5C13D15 |
59.51 |
7.15 |
-8.64 |
-0.85 |
0 |
|
|
248292 |
103080341 |
1 |
O2N5C9H15 |
A2B5C9D15 |
33.31 |
5.48 |
-8.68 |
-0.67 |
0 |
|
|
248293 |
103080343 |
1 |
O2N5C9H17 |
A2B5C9D17 |
20.22 |
7.12 |
-8.87 |
-0.69 |
0 |
|
|
248294 |
103080345 |
1 |
O2N5C11H19 |
A2B5C11D19 |
21.25 |
5.75 |
-8.88 |
-0.71 |
0 |
|
|
248295 |
103080352 |
1 |
O2N5C10H19 |
A2B5C10D19 |
11.22 |
7.02 |
-8.91 |
-0.71 |
0 |
|
|
248296 |
103080359 |
1 |
O2N5C10H17 |
A2B5C10D17 |
31.06 |
6.93 |
-8.86 |
-0.61 |
0 |
|
|
248297 |
103080361 |
1 |
O2N5C10H17 |
A2B5C10D17 |
23.48 |
6.72 |
-8.71 |
-0.66 |
0 |
|
|
248298 |
103080368 |
1 |
F2O2N5C7H11 |
A2B2C5D7E11 |
-73.3 |
7.7 |
-9.24 |
-0.95 |
0 |
|
|
248299 |
103080376 |
1 |
O2N5C11H19 |
A2B5C11D19 |
20.91 |
7.44 |
-8.76 |
-0.66 |
0 |