List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
259225 |
103162173 |
1 |
NO4C16H21 |
AB4C16D21 |
-153.9 |
4.36 |
-9.8 |
-0.38 |
0 |
|
|
259226 |
103162176 |
1 |
NSO4C13H23 |
ABC4D13E23 |
-192.99 |
5.83 |
-9.04 |
0.36 |
0 |
|
|
259227 |
103162177 |
1 |
NO3C13H21 |
AB3C13D21 |
-149.24 |
7.93 |
-10.04 |
0.15 |
0 |
|
|
259228 |
103162178 |
1 |
NO4C15H25 |
AB4C15D25 |
-196.61 |
7.5 |
-9.9 |
0.35 |
0 |
|
|
259229 |
103162185 |
1 |
NO3C16H21 |
AB3C16D21 |
-123.71 |
6.08 |
-9.5 |
0.24 |
0 |
|
|
259230 |
103162188 |
1 |
NO5C14H23 |
AB5C14D23 |
-212.06 |
5.19 |
-9.6 |
0.12 |
0 |
|
|
259231 |
103162189 |
1 |
NO3C12H19 |
AB3C12D19 |
-148.31 |
7.18 |
-9.9 |
0.36 |
0 |
|
|
259232 |
103162190 |
1 |
NO4C14H23 |
AB4C14D23 |
-189.63 |
8.88 |
-9.86 |
0.38 |
0 |
|
|
259233 |
103162191 |
1 |
NO4C16H25 |
AB4C16D25 |
-194.76 |
7.85 |
-9.83 |
0.35 |
0 |
|
|
259234 |
103162192 |
1 |
NO4C11H19 |
AB4C11D19 |
-188.9 |
8.24 |
-10.33 |
0.48 |
0 |
|
|
259235 |
103162196 |
1 |
ClN2O2C16H19 |
AB2C2D16E19 |
-25.93 |
4.07 |
-9.92 |
-0.72 |
0 |
|
|
259236 |
103162199 |
1 |
ClON2C9H13 |
ABC2D9E13 |
-14.82 |
4.08 |
-10.46 |
-0.41 |
0 |
|
|
259237 |
103162202 |
1 |
ClN2O2C12H19 |
AB2C2D12E19 |
-66.85 |
0.8 |
-9.82 |
-0.28 |
0 |
|
|
259238 |
103162203 |
1 |
BrON2C10H15 |
ABC2D10E15 |
-9.04 |
4.0 |
-10.28 |
-1.09 |
0 |
|
|
259239 |
103162206 |
2 |
NOC6H12 |
ABC6D12 |
-97.1 |
3.6 |
-8.89 |
1.13 |
0 |
|
|
259240 |
103162207 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-104.16 |
2.62 |
-8.81 |
1.14 |
0 |
|
|
259241 |
103162213 |
2 |
NOC8H12 |
ABC8D12 |
-80.03 |
4.54 |
-8.83 |
0.1 |
0 |
|
|
259242 |
103162215 |
2 |
NOC8H12 |
ABC8D12 |
-80.58 |
4.76 |
-8.71 |
0.17 |
0 |
|
|
259243 |
103162216 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-78.44 |
3.14 |
-8.7 |
0.08 |
0 |
|
|
259244 |
103162221 |
1 |
ON2C15H22 |
AB2C15D22 |
-31.79 |
2.26 |
-8.66 |
0.3 |
0 |
|
|
259245 |
103162223 |
1 |
ON2C17H26 |
AB2C17D26 |
-44.27 |
3.03 |
-8.76 |
0.18 |
0 |
|
|
259246 |
103162229 |
2 |
NOC8H15 |
ABC8D15 |
-121.93 |
4.65 |
-8.94 |
1.27 |
0 |
|
|
259247 |
103162230 |
1 |
ON2C14H26 |
AB2C14D26 |
-76.6 |
3.34 |
-8.91 |
1.3 |
0 |
|
|
259248 |
103162235 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-13.84 |
5.2 |
-8.76 |
-0.55 |
0 |
|
|
259249 |
103162237 |
1 |
OSN3C13H21 |
ABC3D13E21 |
-18.94 |
3.24 |
-8.94 |
-0.4 |
0 |
|
|
259250 |
103162238 |
1 |
OSN3C14H23 |
ABC3D14E23 |
-23.84 |
3.11 |
-8.95 |
-0.48 |
0 |
|
|
259251 |
103162241 |
1 |
O2N3C14H27 |
A2B3C14D27 |
-94.78 |
2.45 |
-8.91 |
1.35 |
0 |
|
|
259252 |
103162245 |
2 |
NOC6H12 |
ABC6D12 |
-103.91 |
4.89 |
-9.0 |
1.12 |
0 |
|
|
259253 |
103162247 |
1 |
O2N3C15H29 |
A2B3C15D29 |
-98.31 |
3.54 |
-8.77 |
1.28 |
0 |
|
|
259254 |
103162252 |
2 |
NOC7H12 |
ABC7D12 |
-97.09 |
4.6 |
-9.24 |
1.19 |
0 |
|
|
259255 |
103162264 |
3 |
NOC5H9 |
ABC5D9 |
-145.92 |
2.45 |
-9.44 |
0.49 |
0 |
|
|
259256 |
103162270 |
1 |
ON2C11H20 |
AB2C11D20 |
-60.64 |
2.27 |
-9.24 |
1.14 |
0 |
|
|
259257 |
103162296 |
1 |
NSCl3O3C13H14 |
ABC3D3E13F14 |
-132.73 |
8.51 |
-9.89 |
-1.54 |
0 |
|
|
259258 |
103162298 |
1 |
ClNSO4C13H16 |
ABCD4E13F16 |
-156.63 |
11.66 |
-9.81 |
-0.99 |
0 |
|
|
259259 |
103162300 |
1 |
ClNSO4C13H16 |
ABCD4E13F16 |
-146.8 |
10.94 |
-9.13 |
-1.12 |
0 |
|
|
259260 |
103162303 |
1 |
ClNSO4C14H18 |
ABCD4E14F18 |
-153.31 |
7.09 |
-9.98 |
-1.09 |
0 |
|
|
259261 |
103162304 |
1 |
ClNSO3C14H18 |
ABCD3E14F18 |
-118.91 |
7.11 |
-10.35 |
-1.28 |
0 |
|
|
259262 |
103162305 |
1 |
ClNS2O3C12H16 |
ABC2D3E12F16 |
-111.47 |
10.45 |
-9.9 |
-1.46 |
0 |
|
|
259263 |
103162306 |
1 |
ClNS2O3C12H16 |
ABC2D3E12F16 |
-111.63 |
8.74 |
-9.93 |
-1.56 |
0 |
|
|
259264 |
103162325 |
1 |
O4C17H22 |
A4B17C22 |
-138.32 |
5.94 |
-9.04 |
-0.59 |
0 |
|
|
259265 |
103162355 |
1 |
NO2C15H17 |
AB2C15D17 |
-70.19 |
2.17 |
-9.22 |
-0.79 |
0 |
|
|
259266 |
103162356 |
1 |
NO3C17H21 |
AB3C17D21 |
-115.41 |
4.6 |
-9.24 |
-0.83 |
0 |
|
|
259267 |
103162357 |
1 |
N2O3C15H16 |
A2B3C15D16 |
-80.22 |
3.77 |
-9.69 |
-1.12 |
0 |
|
|
259268 |
103162361 |
2 |
O2C8H11 |
A2B8C11 |
-135.88 |
4.62 |
-8.61 |
-0.45 |
0 |
|
|
259269 |
103162363 |
1 |
ClSO2C12H15 |
ABC2D12E15 |
-59.18 |
3.52 |
-9.67 |
-1.2 |
0 |
|
|
259270 |
103162365 |
1 |
BrO3C14H17 |
AB3C14D17 |
-87.5 |
3.84 |
-8.75 |
-0.35 |
0 |
|
|
259271 |
103162370 |
1 |
NSO3C15H21 |
ABC3D15E21 |
-110.81 |
4.08 |
-9.18 |
-0.44 |
0 |
|
|
259272 |
103162371 |
1 |
N2O3C12H16 |
A2B3C12D16 |
-117.93 |
2.69 |
-10.14 |
-0.98 |
0 |
|
|
259273 |
103162378 |
1 |
ON2C13H14 |
AB2C13D14 |
10.19 |
3.49 |
-9.32 |
-0.7 |
0 |
|
|
259274 |
103162383 |
1 |
NO3C14H15 |
AB3C14D15 |
-90.67 |
4.01 |
-9.17 |
-0.93 |
0 |
|
|
259275 |
103162389 |
1 |
IO2C13H15 |
AB2C13D15 |
-40.16 |
5.39 |
-9.17 |
-0.93 |
0 |
|
|
259276 |
103162390 |
1 |
ClO2C13H15 |
AB2C13D15 |
-63.61 |
3.56 |
-9.26 |
-0.6 |
0 |
|
|
259277 |
103162391 |
1 |
ClO3C15H19 |
AB3C15D19 |
-110.22 |
2.8 |
-9.24 |
-0.68 |
0 |
|
|
259278 |
103162392 |
1 |
BrO3C15H19 |
AB3C15D19 |
-98.67 |
2.9 |
-9.34 |
-0.67 |
0 |
|
|
259279 |
103162395 |
1 |
O2C17H18 |
A2B17C18 |
-39.71 |
4.71 |
-8.7 |
-0.64 |
0 |
|
|
259280 |
103162396 |
1 |
NO3C13H13 |
AB3C13D13 |
-83.86 |
1.26 |
-9.6 |
-1.17 |
0 |
|
|
259281 |
103162399 |
1 |
NOC15H17 |
ABC15D17 |
-1.1 |
6.25 |
-8.62 |
-0.28 |
0 |
|
|
259282 |
103162401 |
1 |
NO3C11H13 |
AB3C11D13 |
-99.75 |
4.79 |
-10.25 |
-0.73 |
0 |
|
|
259283 |
103162408 |
1 |
N2O3C14H14 |
A2B3C14D14 |
-6.49 |
10.32 |
-9.6 |
-1.33 |
0 |
|
|
259284 |
103162409 |
1 |
BrO3C14H15 |
AB3C14D15 |
-85.55 |
5.03 |
-9.09 |
-0.49 |
0 |
|
|
259285 |
103162413 |
1 |
BrO3C15H17 |
AB3C15D17 |
-89.56 |
4.92 |
-9.11 |
-0.5 |
0 |
|
|
259286 |
103162414 |
1 |
ClO4C16H21 |
AB4C16D21 |
-143.95 |
5.46 |
-8.72 |
-0.54 |
0 |
|
|
259287 |
103162435 |
1 |
OSCl2C10H10 |
ABC2D10E10 |
-13.63 |
2.55 |
-9.56 |
-1.14 |
0 |
|
|
259288 |
103162569 |
1 |
ClON2C13H13 |
ABC2D13E13 |
3.58 |
4.02 |
-9.3 |
-0.83 |
0 |
|
|
259289 |
103162742 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-98.4 |
2.49 |
-9.28 |
-0.69 |
0 |
|
|
259290 |
103162775 |
1 |
NOC19H31 |
ABC19D31 |
-52.14 |
2.43 |
-8.9 |
0.59 |
0 |
|
|
259291 |
103163082 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-60.24 |
4.52 |
-8.93 |
-0.31 |
0 |
|
|
259292 |
103163087 |
1 |
ON3C15H21 |
AB3C15D21 |
-17.74 |
4.43 |
-8.41 |
-0.04 |
0 |
|
|
259293 |
103163120 |
1 |
NO2C17H25 |
AB2C17D25 |
-67.9 |
4.45 |
-9.01 |
0.22 |
0 |
|
|
259294 |
103163435 |
1 |
NOSC13H21 |
ABCD13E21 |
-22.64 |
2.18 |
-9.08 |
-0.12 |
0 |
|
|
259295 |
103163474 |
1 |
N2C13H28 |
A2B13C28 |
-32.05 |
2.51 |
-8.84 |
2.78 |
0 |
|
|
259296 |
103163490 |
1 |
ON2C12H26 |
AB2C12D26 |
-54.64 |
4.15 |
-8.63 |
2.3 |
0 |
|
|
259297 |
103163633 |
1 |
FSN2O2C15H19 |
ABC2D2E15F19 |
-110.05 |
2.77 |
-8.98 |
-0.95 |
0 |
|
|
259298 |
103163636 |
1 |
OSN2C8H14 |
ABC2D8E14 |
-42.4 |
4.39 |
-8.68 |
-0.36 |
0 |
|
|
259299 |
103163641 |
1 |
OSN2C10H18 |
ABC2D10E18 |
-52.88 |
3.92 |
-8.64 |
-0.32 |
0 |