List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
284200 |
104038332 |
1 |
BrON4C12H13 |
ABC4D12E13 |
38.92 |
6.39 |
-8.66 |
-0.62 |
0 |
|
|
284201 |
104038333 |
1 |
N4C15H18 |
A4B15C18 |
63.55 |
5.15 |
-8.75 |
-0.01 |
0 |
|
|
284202 |
104038334 |
1 |
F3N4C9H13 |
A3B4C9D13 |
-120.94 |
3.62 |
-8.94 |
-0.08 |
0 |
|
|
284203 |
104038335 |
1 |
F3N4C11H15 |
A3B4C11D15 |
-127.09 |
4.46 |
-8.97 |
-0.11 |
0 |
|
|
284204 |
104038344 |
1 |
ON4C11H18 |
AB4C11D18 |
-15.94 |
6.69 |
-8.74 |
0.16 |
0 |
|
|
284205 |
104038345 |
1 |
ON4C12H20 |
AB4C12D20 |
-14.82 |
5.6 |
-8.85 |
0.06 |
0 |
|
|
284206 |
104038347 |
1 |
O2N5C10H13 |
A2B5C10D13 |
-39.93 |
2.31 |
-9.16 |
-0.7 |
0 |
|
|
284207 |
104038348 |
1 |
O2N5C11H15 |
A2B5C11D15 |
-40.34 |
3.65 |
-9.08 |
-0.49 |
0 |
|
|
284208 |
104038350 |
1 |
ON4C9H14 |
AB4C9D14 |
3.27 |
3.42 |
-8.91 |
-0.02 |
0 |
|
|
284209 |
104038354 |
1 |
O2N5C9H11 |
A2B5C9D11 |
-25.46 |
1.75 |
-9.33 |
-0.6 |
0 |
|
|
284210 |
104038356 |
1 |
O2N5C11H15 |
A2B5C11D15 |
-37.39 |
2.04 |
-9.38 |
-0.64 |
0 |
|
|
284211 |
104038358 |
1 |
ON4C10H18 |
AB4C10D18 |
-15.7 |
7.07 |
-8.83 |
0.07 |
0 |
|
|
284212 |
104038361 |
1 |
O2N4C9H16 |
A2B4C9D16 |
-57.26 |
5.57 |
-8.98 |
-0.09 |
0 |
|
|
284213 |
104038366 |
1 |
O2S2N4C11H18 |
A2B2C4D11E18 |
-33.19 |
2.59 |
-8.82 |
-0.43 |
0 |
|
|
284214 |
104038371 |
1 |
ON6C11H16 |
AB6C11D16 |
13.61 |
3.38 |
-8.99 |
-0.17 |
0 |
|
|
284215 |
104038376 |
1 |
ON5C11H15 |
AB5C11D15 |
50.83 |
3.81 |
-8.88 |
-0.24 |
0 |
|
|
284216 |
104038381 |
4 |
NC3H5 |
AB3C5 |
37.63 |
6.28 |
-8.56 |
0.22 |
0 |
|
|
284217 |
104038385 |
1 |
ON5C12H19 |
AB5C12D19 |
10.8 |
6.28 |
-8.84 |
0.07 |
0 |
|
|
284218 |
104038387 |
1 |
SN4C13H18 |
AB4C13D18 |
65.84 |
6.07 |
-8.67 |
-0.27 |
0 |
|
|
284219 |
104038393 |
1 |
FIN4H10C11 |
ABC4D10E11 |
45.62 |
2.48 |
-8.97 |
-1.46 |
0 |
|
|
284220 |
104038396 |
1 |
SO2N4C9H16 |
AB2C4D9E16 |
-40.0 |
6.66 |
-8.87 |
-0.02 |
0 |
|
|
284221 |
104038398 |
1 |
N4C13H22 |
A4B13C22 |
13.61 |
6.06 |
-8.67 |
0.19 |
0 |
|
|
284222 |
104038401 |
1 |
N5C12H19 |
A5B12C19 |
50.12 |
4.56 |
-8.67 |
0.09 |
0 |
|
|
284223 |
104038403 |
1 |
BrClN4H10C11 |
ABC4D10E11 |
71.32 |
2.07 |
-8.95 |
-0.81 |
0 |
|
|
284224 |
104038409 |
1 |
N4C15H26 |
A4B15C26 |
12.85 |
6.05 |
-8.52 |
0.27 |
0 |
|
|
284225 |
104038414 |
1 |
SN4C12H16 |
AB4C12D16 |
62.45 |
5.8 |
-8.83 |
-0.36 |
0 |
|
|
284226 |
104038418 |
1 |
N5C13H17 |
A5B13C17 |
75.4 |
6.72 |
-8.63 |
-0.47 |
0 |
|
|
284227 |
104038419 |
1 |
N5C13H17 |
A5B13C17 |
72.08 |
5.27 |
-8.75 |
-0.2 |
0 |
|
|
284228 |
104038420 |
1 |
ON4C10H18 |
AB4C10D18 |
-19.68 |
4.54 |
-8.89 |
0.0 |
0 |
|
|
284229 |
104038421 |
1 |
ON4C11H20 |
AB4C11D20 |
-19.73 |
7.18 |
-8.82 |
0.07 |
0 |
|
|
284230 |
104038427 |
1 |
N5H13C14 |
A5B13C14 |
101.47 |
3.75 |
-8.81 |
-1.05 |
0 |
|
|
284231 |
104038429 |
1 |
SN4C13H18 |
AB4C13D18 |
61.2 |
5.78 |
-8.77 |
-0.36 |
0 |
|
|
284232 |
104038446 |
1 |
OF3N4H11C12 |
AB3C4D11E12 |
-129.17 |
3.1 |
-8.96 |
-0.83 |
0 |
|
|
284233 |
104038447 |
1 |
Cl2N4H10C11 |
A2B4C10D11 |
58.49 |
2.06 |
-8.93 |
-0.78 |
0 |
|
|
284234 |
104038459 |
1 |
ClON4C13H15 |
ABC4D13E15 |
16.25 |
5.0 |
-8.6 |
-0.58 |
0 |
|
|
284235 |
104038463 |
1 |
ClN4C12H13 |
AB4C12D13 |
56.61 |
4.11 |
-8.93 |
-0.56 |
0 |
|
|
284236 |
104038464 |
1 |
F2N4H10C11 |
A2B4C10D11 |
-17.22 |
2.01 |
-8.99 |
-0.73 |
0 |
|
|
284237 |
104038465 |
1 |
N4C13H16 |
A4B13C16 |
55.28 |
4.8 |
-8.62 |
-0.14 |
0 |
|
|
284238 |
104038469 |
1 |
ClN4C11H11 |
AB4C11D11 |
64.26 |
3.43 |
-8.84 |
-0.6 |
0 |
|
|
284239 |
104038480 |
1 |
N4C13H16 |
A4B13C16 |
52.57 |
4.79 |
-8.61 |
-0.12 |
0 |
|
|
284240 |
104038485 |
1 |
FN4C12H13 |
AB4C12D13 |
18.16 |
4.33 |
-8.81 |
-0.39 |
0 |
|
|
284241 |
104038488 |
1 |
ON4C12H14 |
AB4C12D14 |
31.99 |
2.37 |
-8.7 |
-0.32 |
0 |
|
|
284242 |
104038489 |
1 |
N4C13H16 |
A4B13C16 |
57.61 |
5.55 |
-8.61 |
-0.11 |
0 |
|
|
284243 |
104038490 |
2 |
N2C6H7 |
A2B6C7 |
64.36 |
5.15 |
-8.61 |
-0.15 |
0 |
|
|
284244 |
104038495 |
1 |
N4C13H22 |
A4B13C22 |
22.88 |
6.49 |
-8.44 |
0.3 |
0 |
|
|
284245 |
104038499 |
2 |
N2C7H8 |
A2B7C8 |
69.58 |
5.22 |
-8.8 |
0.04 |
0 |
|
|
284246 |
104038504 |
1 |
N4C11H18 |
A4B11C18 |
29.68 |
5.88 |
-8.63 |
0.16 |
0 |
|
|
284247 |
104038508 |
1 |
N4C11H18 |
A4B11C18 |
30.55 |
5.89 |
-8.65 |
0.15 |
0 |
|
|
284248 |
104038509 |
1 |
N4C11H18 |
A4B11C18 |
33.99 |
5.67 |
-8.6 |
0.18 |
0 |
|
|
284249 |
104038510 |
1 |
ON4C10H16 |
AB4C10D16 |
-0.43 |
3.56 |
-8.8 |
-0.03 |
0 |
|
|
284250 |
104038520 |
1 |
ON5C13H13 |
AB5C13D13 |
43.18 |
2.44 |
-8.66 |
-0.53 |
0 |
|
|
284251 |
104038522 |
1 |
N5C11H19 |
A5B11C19 |
49.18 |
5.12 |
-8.62 |
0.14 |
0 |
|
|
284252 |
104038524 |
1 |
ON4C7H12 |
AB4C7D12 |
0.03 |
4.7 |
-8.97 |
-0.07 |
0 |
|
|
284253 |
104038525 |
1 |
N5C12H15 |
A5B12C15 |
75.62 |
6.49 |
-8.76 |
-0.39 |
0 |
|
|
284254 |
104038526 |
1 |
ClN4C12H13 |
AB4C12D13 |
62.23 |
3.91 |
-8.9 |
-0.56 |
0 |
|
|
284255 |
104038528 |
1 |
N4C11H18 |
A4B11C18 |
24.24 |
5.89 |
-8.71 |
0.18 |
0 |
|
|
284256 |
104038529 |
2 |
N2C4H7 |
A2B4C7 |
34.51 |
5.72 |
-8.75 |
0.13 |
0 |
|
|
284257 |
104038531 |
1 |
ON4C10H12 |
AB4C10D12 |
40.72 |
4.91 |
-8.93 |
-0.07 |
0 |
|
|
284258 |
104038533 |
1 |
N4C9H16 |
A4B9C16 |
25.96 |
5.89 |
-8.68 |
0.2 |
0 |
|
|
284259 |
104038538 |
2 |
N2C3H5 |
A2B3C5 |
46.29 |
5.16 |
-8.84 |
0.06 |
0 |
|
|
284260 |
104038541 |
1 |
ON5C7H11 |
AB5C7D11 |
4.32 |
2.05 |
-9.18 |
-0.29 |
0 |
|
|
284261 |
104038546 |
1 |
N5C13H25 |
A5B13C25 |
21.29 |
5.72 |
-8.58 |
0.09 |
0 |
|
|
284262 |
104038547 |
1 |
N4C17H26 |
A4B17C26 |
9.16 |
5.98 |
-8.73 |
0.15 |
0 |
|
|
284263 |
104038561 |
1 |
N4C13H22 |
A4B13C22 |
20.41 |
5.95 |
-8.73 |
0.15 |
0 |
|
|
284264 |
104038566 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-7.66 |
6.26 |
-8.78 |
-0.13 |
0 |
|
|
284265 |
104038571 |
2 |
ON2C4H6 |
AB2C4D6 |
-36.31 |
4.84 |
-8.99 |
-0.09 |
0 |
|
|
284266 |
104038909 |
1 |
O3N4C13H14 |
A3B4C13D14 |
23.5 |
7.68 |
-9.1 |
-1.49 |
0 |
|
|
284267 |
104039074 |
1 |
O2S2N3C12H13 |
A2B2C3D12E13 |
-4.71 |
6.35 |
-9.11 |
-1.3 |
0 |
|
|
284268 |
104039125 |
1 |
ON3C14H17 |
AB3C14D17 |
7.63 |
5.96 |
-8.55 |
-0.05 |
0 |
|
|
284269 |
104039138 |
1 |
N5C15H27 |
A5B15C27 |
13.71 |
4.41 |
-8.39 |
0.49 |
0 |
|
|
284270 |
104039142 |
1 |
N5C9H11 |
A5B9C11 |
69.17 |
2.39 |
-8.93 |
0.13 |
0 |
|
|
284271 |
104039143 |
1 |
N7C8H11 |
A7B8C11 |
99.01 |
4.96 |
-8.82 |
-0.65 |
0 |
|
|
284272 |
104039146 |
2 |
ON2C6H6 |
AB2C6D6 |
46.8 |
3.61 |
-8.86 |
-1.53 |
0 |
|
|
284273 |
104039148 |
1 |
N5C12H17 |
A5B12C17 |
48.88 |
3.57 |
-8.62 |
0.43 |
0 |
|
|
284274 |
104039150 |
1 |
N3C9H11 |
A3B9C11 |
76.1 |
3.58 |
-8.7 |
0.37 |
0 |
|
|
284275 |
104039154 |
3 |
N2C3H4 |
A2B3C4 |
71.31 |
3.56 |
-8.92 |
-0.01 |
0 |
|
|
284276 |
104039195 |
1 |
SN4C11H14 |
AB4C11D14 |
48.23 |
2.61 |
-8.72 |
-0.56 |
0 |
|
|
284277 |
104039255 |
1 |
NO3C12H17 |
AB3C12D17 |
-128.89 |
4.42 |
-9.52 |
-0.44 |
0 |
|
|
284278 |
104039324 |
1 |
BrClN2O2H8C12 |
ABC2D2E8F12 |
-41.23 |
3.8 |
-8.75 |
-1.36 |
0 |
|
|
284279 |
104039365 |
1 |
NO2C13H15 |
AB2C13D15 |
-59.63 |
4.52 |
-9.33 |
-0.27 |
0 |
|
|
284280 |
104039371 |
1 |
NF3O4C11H12 |
AB3C4D11E12 |
-315.42 |
5.11 |
-9.7 |
-0.58 |
0 |
|
|
284281 |
104039422 |
1 |
NO3C12H17 |
AB3C12D17 |
-131.69 |
3.05 |
-9.44 |
-0.54 |
0 |
|
|
284282 |
104039544 |
1 |
ON5C11H19 |
AB5C11D19 |
-8.92 |
1.8 |
-8.81 |
-0.69 |
0 |
|
|
284283 |
104039882 |
1 |
ClNO2C14H22 |
ABC2D14E22 |
-86.02 |
4.17 |
-9.05 |
0.1 |
0 |
|
|
284284 |
104040005 |
1 |
SN2O5C13H22 |
AB2C5D13E22 |
-228.58 |
8.4 |
-9.72 |
0.26 |
0 |
|
|
284285 |
104040006 |
1 |
SN2O3C14H24 |
AB2C3D14E24 |
-153.26 |
4.89 |
-8.58 |
0.37 |
0 |
|
|
284286 |
104040008 |
1 |
SN2O3C14H26 |
AB2C3D14E26 |
-151.1 |
4.83 |
-8.6 |
0.48 |
0 |
|
|
284287 |
104040010 |
1 |
N2O3C16H28 |
A2B3C16D28 |
-166.73 |
4.54 |
-9.07 |
0.53 |
0 |
|
|
284288 |
104040011 |
1 |
N3O4C14H25 |
A3B4C14D25 |
-190.77 |
7.94 |
-9.33 |
0.26 |
0 |
|
|
284289 |
104040015 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-70.21 |
1.54 |
-9.42 |
0.1 |
0 |
|
|
284290 |
104040016 |
2 |
ON2C5H10 |
AB2C5D10 |
-98.13 |
1.5 |
-9.32 |
1.02 |
0 |
|
|
284291 |
104040017 |
1 |
O3N4C10H20 |
A3B4C10D20 |
-133.49 |
2.46 |
-9.36 |
0.81 |
0 |
|
|
284292 |
104040018 |
1 |
O2F3N4C8H15 |
A2B3C4D8E15 |
-256.62 |
2.16 |
-9.54 |
0.38 |
0 |
|
|
284293 |
104040019 |
1 |
O2N4C11H22 |
A2B4C11D22 |
-102.21 |
2.03 |
-9.24 |
1.01 |
0 |
|
|
284294 |
104040020 |
1 |
O2N4C9H18 |
A2B4C9D18 |
-76.49 |
0.95 |
-9.42 |
0.89 |
0 |
|
|
284295 |
104040116 |
1 |
ON2C10H18 |
AB2C10D18 |
-43.85 |
4.14 |
-9.26 |
0.76 |
0 |
|
|
284296 |
104040857 |
1 |
ON2C12H22 |
AB2C12D22 |
-70.5 |
3.49 |
-9.04 |
1.16 |
0 |
|
|
284297 |
104040971 |
1 |
ON3C14H21 |
AB3C14D21 |
-38.98 |
4.1 |
-9.03 |
-0.01 |
0 |
|
|
284298 |
104040972 |
1 |
BrON3C12H16 |
ABC3D12E16 |
-30.66 |
7.89 |
-9.01 |
-0.52 |
0 |
|
|
284299 |
104040973 |
1 |
ON3C16H29 |
AB3C16D29 |
-68.14 |
3.4 |
-8.5 |
1.1 |
0 |