List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
179284 |
76461397 |
1 |
ClN2O3C19H21 |
AB2C3D19E21 |
-85.03 |
2.86 |
-9.09 |
-1.01 |
0 |
|
|
179285 |
76461398 |
1 |
Br2N2O3C19H20 |
A2B2C3D19E20 |
-72.58 |
2.4 |
-9.35 |
-1.2 |
0 |
|
|
179286 |
76461399 |
1 |
Br2N2O3C19H20 |
A2B2C3D19E20 |
-72.06 |
1.8 |
-9.31 |
-1.22 |
0 |
|
|
179287 |
76461400 |
2 |
N3O3C18H31 |
A3B3C18D31 |
-281.88 |
3.84 |
-8.93 |
-0.68 |
0 |
|
|
179288 |
76461401 |
1 |
OSN3C25H31 |
ABC3D25E31 |
8.85 |
1.0 |
-8.38 |
-0.44 |
0 |
|
|
179289 |
76461531 |
1 |
ClN2P2O7C13H13 |
AB2C2D7E13F13 |
-362.01 |
4.47 |
-9.71 |
-1.23 |
0 |
|
|
179290 |
76461676 |
1 |
N2O2H16C19 |
A2B2C16D19 |
16.69 |
3.37 |
-8.6 |
-1.05 |
0 |
|
|
179291 |
76461895 |
1 |
NO4C12H23 |
AB4C12D23 |
-217.54 |
1.53 |
-10.14 |
0.33 |
0 |
|
|
179292 |
76462155 |
1 |
O5N9H19C21 |
A5B9C19D21 |
-36.01 |
3.76 |
-8.89 |
-1.4 |
0 |
|
|
179293 |
76462156 |
1 |
BrSi2O5N6C25H45 |
AB2C5D6E25F45 |
-288.85 |
2.4 |
-8.89 |
-0.72 |
0 |
|
|
179294 |
76462157 |
1 |
NSO3C19H23 |
ABC3D19E23 |
-92.93 |
6.97 |
-9.04 |
-0.59 |
0 |
|
|
179295 |
76462158 |
1 |
O3H20C23 |
A3B20C23 |
-44.69 |
4.53 |
-9.3 |
-1.29 |
0 |
|
|
179296 |
76462219 |
1 |
O12C25H28 |
A12B25C28 |
-475.11 |
6.69 |
-10.0 |
-1.38 |
0 |
|
|
179297 |
76462701 |
1 |
OSiC17H20 |
ABC17D20 |
-38.15 |
1.3 |
-9.18 |
0.29 |
0 |
|
|
179298 |
76462870 |
1 |
NSeO3C14H17 |
ABC3D14E17 |
-92.07 |
3.71 |
-9.14 |
-0.36 |
0 |
|
|
179299 |
76463313 |
1 |
O9C22H32 |
A9B22C32 |
-407.93 |
3.43 |
-10.36 |
-0.4 |
1 |
|
|
179300 |
76463487 |
1 |
NO2C53H72 |
AB2C53D72 |
-47.68 |
1.3 |
0.0 |
0.0 |
0 |
|
|
179301 |
76463488 |
1 |
BrNO2F4H36C37 |
ABC2D4E36F37 |
-189.49 |
10.45 |
-8.42 |
-0.75 |
1 |
|
|
179302 |
76463489 |
1 |
NO2F4H36C37 |
AB2C4D36E37 |
-142.74 |
3.21 |
0.0 |
0.0 |
0 |
|
|
179303 |
76463566 |
1 |
NO8C32H51 |
AB8C32D51 |
-375.33 |
8.82 |
-9.34 |
-0.35 |
0 |
|
|
179304 |
76463567 |
1 |
NO8C33H51 |
AB8C33D51 |
-365.84 |
4.33 |
-9.57 |
-0.49 |
0 |
|
|
179305 |
76463785 |
1 |
C19H36 |
A19B36 |
-55.74 |
0.21 |
-8.86 |
0.51 |
0 |
|
|
179306 |
76463786 |
1 |
C17H30 |
A17B30 |
-27.02 |
1.01 |
-8.9 |
1.52 |
0 |
|
|
179307 |
76463969 |
1 |
O5C43H74 |
A5B43C74 |
-298.35 |
1.02 |
-9.42 |
0.56 |
0 |
|
|
179308 |
76463970 |
1 |
O5C43H70 |
A5B43C70 |
-252.54 |
0.73 |
-9.38 |
0.57 |
0 |
|
|
179309 |
76463976 |
1 |
O5C40H76 |
A5B40C76 |
-380.05 |
4.78 |
-9.54 |
0.4 |
0 |
|
|
179310 |
76464313 |
1 |
O6C55H90 |
A6B55C90 |
-326.15 |
2.92 |
-9.43 |
0.63 |
0 |
|
|
179311 |
76464314 |
2 |
O3C28H49 |
A3B28C49 |
-401.45 |
2.75 |
-9.38 |
0.62 |
0 |
|
|
179312 |
76464315 |
1 |
O6C59H104 |
A6B59C104 |
-416.15 |
2.79 |
-9.43 |
0.62 |
0 |
|
|
179313 |
76464316 |
2 |
O3C28H46 |
A3B28C46 |
-330.64 |
1.43 |
-9.44 |
0.48 |
0 |
|
|
179314 |
76464784 |
1 |
O6C53H90 |
A6B53C90 |
-359.57 |
4.71 |
-9.38 |
0.66 |
0 |
|
|
179315 |
76465129 |
1 |
O6C55H96 |
A6B55C96 |
-398.16 |
2.66 |
-9.37 |
0.59 |
0 |
|
|
179316 |
76465476 |
3 |
O2C17H32 |
A2B17C32 |
-469.99 |
2.85 |
-9.45 |
0.63 |
0 |
|
|
179317 |
76465598 |
2 |
O3C27H49 |
A3B27C49 |
-437.26 |
2.35 |
-9.43 |
0.6 |
0 |
|
|
179318 |
76466516 |
2 |
O3C31H49 |
A3B31C49 |
-286.54 |
1.14 |
-9.36 |
0.63 |
0 |
|
|
179319 |
76466608 |
1 |
O6C57H106 |
A6B57C106 |
-475.77 |
4.16 |
-9.53 |
0.67 |
0 |
|
|
179320 |
76466818 |
2 |
O3C30H52 |
A3B30C52 |
-398.01 |
2.88 |
-9.42 |
0.67 |
0 |
|
|
179321 |
76466819 |
6 |
OC10H17 |
AB10C17 |
-372.6 |
4.34 |
-9.41 |
0.68 |
0 |
|
|
179322 |
76466820 |
2 |
O3C30H50 |
A3B30C50 |
-353.09 |
4.5 |
-9.3 |
0.55 |
0 |
|
|
179323 |
76466821 |
2 |
O3C30H49 |
A3B30C49 |
-327.74 |
5.03 |
-9.41 |
0.55 |
0 |
|
|
179324 |
76466904 |
3 |
O2C19H32 |
A2B19C32 |
-356.21 |
3.69 |
-9.38 |
0.64 |
0 |
|
|
179325 |
76466981 |
2 |
O3C28H51 |
A3B28C51 |
-446.79 |
3.27 |
-9.55 |
0.52 |
0 |
|
|
179326 |
76467259 |
2 |
O3C29H50 |
A3B29C50 |
-385.52 |
1.81 |
-9.39 |
0.53 |
0 |
|
|
179327 |
76467277 |
1 |
O6C59H104 |
A6B59C104 |
-414.24 |
2.63 |
-9.38 |
0.64 |
0 |
|
|
179328 |
76467278 |
1 |
O6C59H102 |
A6B59C102 |
-394.05 |
2.45 |
-9.34 |
0.61 |
0 |
|
|
179329 |
76467291 |
2 |
O3C31H55 |
A3B31C55 |
-428.9 |
2.39 |
-9.47 |
0.53 |
0 |
|
|
179330 |
76467355 |
2 |
O3C30H52 |
A3B30C52 |
-394.32 |
3.68 |
-9.42 |
0.66 |
0 |
|
|
179331 |
76467425 |
2 |
O3C30H52 |
A3B30C52 |
-400.04 |
2.76 |
-9.31 |
0.58 |
0 |
|
|
179332 |
76467426 |
6 |
OC10H17 |
AB10C17 |
-374.4 |
2.28 |
-9.39 |
0.58 |
0 |
|
|
179333 |
76467600 |
1 |
O6C63H106 |
A6B63C106 |
-363.95 |
3.44 |
-9.43 |
0.61 |
0 |