List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
277200 |
103827272 |
1 |
ClN2O2C9H11 |
AB2C2D9E11 |
-77.0 |
3.77 |
-8.86 |
-0.96 |
0 |
|
|
277201 |
103827278 |
1 |
ClN2O2C9H11 |
AB2C2D9E11 |
-73.4 |
3.81 |
-8.9 |
-1.02 |
0 |
|
|
277202 |
103827287 |
1 |
NO2C12H23 |
AB2C12D23 |
-131.5 |
4.43 |
-9.08 |
2.42 |
0 |
|
|
277203 |
103827290 |
2 |
NOC5H10 |
ABC5D10 |
-109.93 |
2.33 |
-9.13 |
0.97 |
0 |
|
|
277204 |
103827292 |
2 |
NOC7H9 |
ABC7D9 |
-45.24 |
6.61 |
-9.01 |
-0.3 |
0 |
|
|
277205 |
103827296 |
1 |
ON2C17H28 |
AB2C17D28 |
-56.85 |
3.55 |
-9.16 |
0.33 |
0 |
|
|
277206 |
103827297 |
1 |
NOC17H29 |
ABC17D29 |
-72.05 |
2.08 |
-8.94 |
0.34 |
0 |
|
|
277207 |
103827298 |
1 |
NOC16H27 |
ABC16D27 |
-66.91 |
3.49 |
-8.98 |
0.3 |
0 |
|
|
277208 |
103827299 |
1 |
ClNC13H18 |
ABC13D18 |
8.62 |
3.0 |
-9.13 |
0.23 |
0 |
|
|
277209 |
103827316 |
1 |
ON3C13H17 |
AB3C13D17 |
-0.45 |
4.16 |
-9.36 |
0.09 |
0 |
|
|
277210 |
103827320 |
2 |
NOC8H12 |
ABC8D12 |
-86.73 |
3.68 |
-9.35 |
0.18 |
0 |
|
|
277211 |
103827329 |
1 |
ClON2C17H19 |
ABC2D17E19 |
-17.68 |
6.62 |
-9.0 |
-0.17 |
0 |
|
|
277212 |
103827330 |
1 |
ON2C16H26 |
AB2C16D26 |
-57.3 |
3.64 |
-9.28 |
0.24 |
0 |
|
|
277213 |
103827334 |
1 |
ON2C18H22 |
AB2C18D22 |
-15.03 |
5.19 |
-8.6 |
0.11 |
0 |
|
|
277214 |
103827335 |
1 |
ON2C18H22 |
AB2C18D22 |
-16.56 |
4.17 |
-8.46 |
0.13 |
0 |
|
|
277215 |
103827338 |
1 |
OSN3C16H17 |
ABC3D16E17 |
22.71 |
8.32 |
-8.76 |
-0.8 |
0 |
|
|
277216 |
103827339 |
1 |
ON2C17H26 |
AB2C17D26 |
-45.59 |
3.76 |
-9.23 |
0.3 |
0 |
|
|
277217 |
103827340 |
1 |
ON2C16H24 |
AB2C16D24 |
-20.95 |
3.61 |
-8.94 |
0.59 |
0 |
|
|
277218 |
103827341 |
1 |
NO2C18H29 |
AB2C18D29 |
-100.85 |
2.48 |
-9.17 |
0.36 |
0 |
|
|
277219 |
103827342 |
1 |
NO2C15H25 |
AB2C15D25 |
-96.17 |
2.51 |
-9.13 |
0.39 |
0 |
|
|
277220 |
103827344 |
1 |
NO3C17H23 |
AB3C17D23 |
-87.43 |
2.16 |
-9.2 |
0.29 |
0 |
|
|
277221 |
103827345 |
1 |
NOF2C17H19 |
ABC2D17E19 |
-105.0 |
3.51 |
-9.3 |
-0.46 |
0 |
|
|
277222 |
103827347 |
1 |
NO2C16H25 |
AB2C16D25 |
-98.31 |
0.88 |
-9.13 |
0.4 |
0 |
|
|
277223 |
103827348 |
1 |
NSO2C17H23 |
ABC2D17E23 |
-50.7 |
2.07 |
-9.18 |
-0.26 |
0 |
|
|
277224 |
103827349 |
1 |
BrN2C15H17 |
AB2C15D17 |
47.79 |
3.38 |
-9.25 |
-0.54 |
0 |
|
|
277225 |
103827358 |
1 |
N2C13H18 |
A2B13C18 |
30.26 |
2.66 |
-9.17 |
0.37 |
0 |
|
|
277226 |
103827362 |
1 |
ClNC13H18 |
ABC13D18 |
11.56 |
2.75 |
-9.18 |
0.33 |
0 |
|
|
277227 |
103827374 |
1 |
OSN5H13C14 |
ABC5D13E14 |
57.76 |
7.42 |
-9.09 |
-1.21 |
0 |
|
|
277228 |
103827381 |
1 |
NCl3C11H12 |
AB3C11D12 |
5.09 |
3.22 |
-9.44 |
-0.5 |
0 |
|
|
277229 |
103827388 |
1 |
NSO4C11H23 |
ABC4D11E23 |
-198.25 |
6.94 |
-9.3 |
0.43 |
0 |
|
|
277230 |
103827389 |
1 |
SN2O2C11H20 |
AB2C2D11E20 |
-51.7 |
7.83 |
-9.51 |
0.72 |
0 |
|
|
277231 |
103827393 |
1 |
FON2C11H13 |
ABC2D11E13 |
-76.24 |
4.37 |
-8.55 |
0.02 |
0 |
|
|
277232 |
103827395 |
1 |
FNO2C13H18 |
ABC2D13E18 |
-121.69 |
4.01 |
-8.32 |
0.24 |
0 |
|
|
277233 |
103827398 |
1 |
FNOC12H14 |
ABCD12E14 |
-73.5 |
5.85 |
-8.45 |
0.15 |
0 |
|
|
277234 |
103827400 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-127.89 |
1.59 |
-8.63 |
-0.05 |
0 |
|
|
277235 |
103827404 |
1 |
N2O2C19H38 |
A2B2C19D38 |
-168.23 |
1.84 |
-8.81 |
0.94 |
0 |
|
|
277236 |
103827412 |
1 |
NF3O4C12H12 |
AB3C4D12E12 |
-303.53 |
7.08 |
-10.16 |
-0.93 |
0 |
|
|
277237 |
103827415 |
1 |
NO2C15H15 |
AB2C15D15 |
-60.29 |
3.91 |
-8.85 |
-0.25 |
0 |
|
|
277238 |
103827434 |
1 |
BrClNO2H9C13 |
ABCD2E9F13 |
-43.34 |
3.55 |
-9.05 |
-1.21 |
0 |
|
|
277239 |
103827440 |
1 |
ClON3H10C16 |
ABC3D10E16 |
93.5 |
3.09 |
-9.75 |
-1.66 |
0 |
|
|
277240 |
103827443 |
1 |
OSN4H12C15 |
ABC4D12E15 |
101.26 |
3.03 |
-9.34 |
-1.54 |
0 |
|
|
277241 |
103827444 |
1 |
O2N3H11C16 |
A2B3C11D16 |
75.49 |
4.67 |
-9.07 |
-2.12 |
0 |
|
|
277242 |
103827445 |
1 |
ON3H13C17 |
AB3C13D17 |
96.02 |
3.11 |
-9.68 |
-1.47 |
0 |
|
|
277243 |
103827447 |
1 |
ON4H10C15 |
AB4C10D15 |
118.51 |
4.38 |
-9.93 |
-1.54 |
0 |
|
|
277244 |
103827454 |
1 |
ON3C15H15 |
AB3C15D15 |
58.94 |
3.58 |
-10.02 |
-1.51 |
0 |
|
|
277245 |
103827455 |
1 |
ON3C13H13 |
AB3C13D13 |
57.81 |
3.52 |
-10.1 |
-1.46 |
0 |
|
|
277246 |
103827457 |
1 |
O2N3C13H13 |
A2B3C13D13 |
27.55 |
3.35 |
-10.08 |
-1.58 |
0 |
|
|
277247 |
103827463 |
1 |
O2N3C14H15 |
A2B3C14D15 |
22.29 |
2.65 |
-9.88 |
-1.56 |
0 |
|
|
277248 |
103827464 |
1 |
ON3C14H15 |
AB3C14D15 |
52.29 |
3.63 |
-10.02 |
-1.5 |
0 |
|
|
277249 |
103827483 |
4 |
NC4H7 |
AB4C7 |
-0.32 |
5.45 |
-8.64 |
0.19 |
0 |