List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275200 |
103814529 |
1 |
ON3C11H15 |
AB3C11D15 |
-24.01 |
4.23 |
-8.9 |
-0.11 |
0 |
|
|
275201 |
103814533 |
1 |
O2N3C12H17 |
A2B3C12D17 |
-66.55 |
2.33 |
-9.19 |
-0.35 |
0 |
|
|
275202 |
103814545 |
1 |
O2N3C11H15 |
A2B3C11D15 |
-57.46 |
3.18 |
-9.08 |
-0.32 |
0 |
|
|
275203 |
103814550 |
1 |
ON3C11H15 |
AB3C11D15 |
-21.91 |
2.01 |
-9.15 |
-0.31 |
0 |
|
|
275204 |
103814563 |
1 |
O2N3C11H21 |
A2B3C11D21 |
-84.65 |
3.43 |
-8.98 |
1.01 |
0 |
|
|
275205 |
103814577 |
1 |
ON3C12H23 |
AB3C12D23 |
-60.85 |
3.9 |
-8.94 |
1.2 |
0 |
|
|
275206 |
103814581 |
1 |
ON3C13H19 |
AB3C13D19 |
-23.37 |
5.75 |
-8.69 |
0.07 |
0 |
|
|
275207 |
103814583 |
1 |
ON3C13H25 |
AB3C13D25 |
-66.78 |
3.98 |
-8.92 |
1.29 |
0 |
|
|
275208 |
103814590 |
1 |
ON3C12H23 |
AB3C12D23 |
-56.17 |
3.46 |
-8.98 |
1.05 |
0 |
|
|
275209 |
103814594 |
1 |
ON3C15H27 |
AB3C15D27 |
-62.78 |
3.77 |
-8.92 |
1.1 |
0 |
|
|
275210 |
103814597 |
1 |
ON3C10H21 |
AB3C10D21 |
-55.68 |
3.52 |
-8.51 |
1.08 |
0 |
|
|
275211 |
103814611 |
1 |
ON3C9H19 |
AB3C9D19 |
-54.71 |
4.16 |
-9.0 |
1.02 |
0 |
|
|
275212 |
103814621 |
1 |
ON3C14H27 |
AB3C14D27 |
-67.09 |
4.62 |
-8.86 |
1.29 |
0 |
|
|
275213 |
103814631 |
1 |
ON3C12H23 |
AB3C12D23 |
-52.74 |
5.03 |
-9.0 |
0.92 |
0 |
|
|
275214 |
103814639 |
1 |
OSN4C10H18 |
ABC4D10E18 |
-26.07 |
2.53 |
-8.47 |
0.63 |
0 |
|
|
275215 |
103814641 |
1 |
ON4C10H18 |
AB4C10D18 |
-36.86 |
5.87 |
-9.36 |
0.39 |
0 |
|
|
275216 |
103814650 |
1 |
ON4C8H14 |
AB4C8D14 |
-28.26 |
5.78 |
-9.12 |
0.64 |
0 |
|
|
275217 |
103814658 |
1 |
ON4C9H14 |
AB4C9D14 |
-20.98 |
4.77 |
-9.15 |
0.66 |
0 |
|
|
275218 |
103814659 |
1 |
ON3C11H17 |
AB3C11D17 |
-20.32 |
5.64 |
-9.14 |
-0.32 |
0 |
|
|
275219 |
103814664 |
1 |
ON3C13H25 |
AB3C13D25 |
-65.57 |
4.25 |
-8.84 |
1.02 |
0 |
|
|
275220 |
103814665 |
1 |
ON3C14H25 |
AB3C14D25 |
-56.19 |
3.75 |
-8.64 |
1.23 |
0 |
|
|
275221 |
103814666 |
1 |
ON3C13H23 |
AB3C13D23 |
-53.2 |
2.75 |
-8.7 |
1.11 |
0 |
|
|
275222 |
103814667 |
1 |
ON3C12H21 |
AB3C12D21 |
-43.5 |
6.14 |
-8.9 |
0.92 |
0 |
|
|
275223 |
103814674 |
1 |
ON3C11H19 |
AB3C11D19 |
-38.47 |
7.07 |
-9.0 |
0.83 |
0 |
|
|
275224 |
103814678 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-28.86 |
2.61 |
-8.61 |
0.74 |
0 |
|
|
275225 |
103814683 |
1 |
ON3C12H19 |
AB3C12D19 |
-34.74 |
7.55 |
-9.03 |
0.85 |
0 |
|
|
275226 |
103814694 |
1 |
ON3C12H19 |
AB3C12D19 |
-31.52 |
6.43 |
-8.95 |
0.84 |
0 |
|
|
275227 |
103814696 |
1 |
ON3C11H19 |
AB3C11D19 |
-38.43 |
5.8 |
-8.94 |
0.9 |
0 |
|
|
275228 |
103814700 |
1 |
ON3C12H19 |
AB3C12D19 |
-29.76 |
5.53 |
-8.9 |
0.99 |
0 |
|
|
275229 |
103814703 |
1 |
O2N3C10H17 |
A2B3C10D17 |
-62.66 |
5.67 |
-8.87 |
0.96 |
0 |
|
|
275230 |
103814704 |
1 |
ON3C14H23 |
AB3C14D23 |
-46.27 |
5.36 |
-8.85 |
1.02 |
0 |
|
|
275231 |
103814710 |
1 |
ON3C9H15 |
AB3C9D15 |
-28.83 |
7.22 |
-9.02 |
0.82 |
0 |
|
|
275232 |
103814722 |
1 |
ON4C14H24 |
AB4C14D24 |
-27.27 |
4.22 |
-8.76 |
1.03 |
0 |
|
|
275233 |
103814725 |
1 |
ON3C12H21 |
AB3C12D21 |
-42.2 |
5.26 |
-8.95 |
0.89 |
0 |
|
|
275234 |
103814735 |
1 |
ON3C16H19 |
AB3C16D19 |
3.05 |
4.03 |
-8.84 |
0.2 |
0 |
|
|
275235 |
103814736 |
1 |
ON3C12H21 |
AB3C12D21 |
-43.68 |
5.0 |
-8.81 |
1.05 |
0 |
|
|
275236 |
103814740 |
1 |
ON5C10H17 |
AB5C10D17 |
-1.81 |
5.06 |
-9.71 |
0.06 |
0 |
|
|
275237 |
103814742 |
1 |
ON3C14H27 |
AB3C14D27 |
-73.65 |
3.91 |
-8.87 |
1.02 |
0 |
|
|
275238 |
103814744 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-35.03 |
3.45 |
-9.55 |
-0.76 |
0 |
|
|
275239 |
103814745 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-27.98 |
2.25 |
-9.37 |
-0.56 |
0 |
|
|
275240 |
103814753 |
1 |
ON3C14H21 |
AB3C14D21 |
-30.53 |
3.15 |
-8.89 |
-0.22 |
0 |
|
|
275241 |
103814763 |
1 |
OSN3C10H17 |
ABC3D10E17 |
-36.65 |
3.54 |
-9.41 |
-0.41 |
0 |
|
|
275242 |
103814766 |
1 |
OSN3C14H17 |
ABC3D14E17 |
0.81 |
1.85 |
-9.5 |
-0.51 |
0 |
|
|
275243 |
103814779 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-38.86 |
4.05 |
-9.32 |
-0.54 |
0 |
|
|
275244 |
103814787 |
1 |
OSN3C10H17 |
ABC3D10E17 |
-34.25 |
4.67 |
-9.52 |
-0.67 |
0 |
|
|
275245 |
103814788 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-31.96 |
2.48 |
-9.1 |
-0.59 |
0 |
|
|
275246 |
103814790 |
1 |
OSN3C9H15 |
ABC3D9E15 |
-23.53 |
2.4 |
-9.32 |
-0.48 |
0 |
|
|
275247 |
103814801 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-41.61 |
1.87 |
-9.46 |
-0.4 |
0 |
|
|
275248 |
103814808 |
1 |
SO2N3C11H17 |
AB2C3D11E17 |
-66.99 |
4.79 |
-9.0 |
-0.6 |
0 |
|
|
275249 |
103814826 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-43.34 |
3.92 |
-9.01 |
0.01 |
0 |
|
|
275250 |
103814831 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-35.48 |
4.6 |
-8.91 |
-0.6 |
0 |
|
|
275251 |
103814832 |
1 |
OSN3C12H21 |
ABC3D12E21 |
-45.32 |
1.93 |
-9.5 |
-0.48 |
0 |
|
|
275252 |
103814837 |
1 |
OSN3C11H17 |
ABC3D11E17 |
-11.9 |
5.6 |
-9.27 |
-0.6 |
0 |
|
|
275253 |
103814847 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-26.15 |
5.25 |
-9.39 |
-0.64 |
0 |
|
|
275254 |
103814855 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-44.04 |
3.38 |
-9.49 |
-0.54 |
0 |
|
|
275255 |
103814858 |
1 |
OSN3C16H19 |
ABC3D16E19 |
-1.03 |
2.72 |
-9.32 |
-0.58 |
0 |
|
|
275256 |
103814867 |
1 |
OSN3C11H17 |
ABC3D11E17 |
-25.81 |
3.62 |
-9.59 |
-0.69 |
0 |
|
|
275257 |
103814868 |
1 |
OSN3C12H21 |
ABC3D12E21 |
-47.12 |
4.24 |
-9.42 |
-0.64 |
0 |
|
|
275258 |
103814869 |
1 |
SO2N3C10H17 |
AB2C3D10E17 |
-63.86 |
3.67 |
-9.54 |
-0.52 |
0 |
|
|
275259 |
103814871 |
1 |
ClOSN3C13H14 |
ABCD3E13F14 |
-8.65 |
3.11 |
-9.03 |
-0.42 |
0 |
|
|
275260 |
103814874 |
1 |
OSN3C14H17 |
ABC3D14E17 |
4.66 |
2.74 |
-9.54 |
-0.53 |
0 |
|
|
275261 |
103814886 |
1 |
OSN3C13H15 |
ABC3D13E15 |
3.06 |
2.15 |
-8.71 |
-0.5 |
0 |
|
|
275262 |
103814889 |
1 |
OSN3C14H23 |
ABC3D14E23 |
-42.66 |
1.76 |
-9.3 |
-0.53 |
0 |
|
|
275263 |
103814890 |
1 |
OSN4C14H24 |
ABC4D14E24 |
-27.6 |
1.61 |
-8.8 |
-0.52 |
0 |
|
|
275264 |
103814894 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-33.77 |
3.96 |
-9.2 |
-0.57 |
0 |
|
|
275265 |
103814911 |
1 |
ON3C15H25 |
AB3C15D25 |
-47.25 |
5.44 |
-8.39 |
0.32 |
0 |
|
|
275266 |
103814915 |
1 |
OSN3C12H27 |
ABC3D12E27 |
-71.82 |
2.72 |
-8.46 |
0.92 |
0 |
|
|
275267 |
103814916 |
1 |
ON3C16H27 |
AB3C16D27 |
-42.0 |
2.5 |
-8.81 |
0.33 |
0 |
|
|
275268 |
103814921 |
1 |
ON3C12H27 |
AB3C12D27 |
-78.62 |
5.53 |
-8.9 |
1.36 |
0 |
|
|
275269 |
103814923 |
1 |
ON3C16H27 |
AB3C16D27 |
-45.05 |
2.95 |
-8.77 |
0.4 |
0 |
|
|
275270 |
103814926 |
1 |
ON3C12H27 |
AB3C12D27 |
-85.2 |
4.91 |
-8.71 |
1.25 |
0 |
|
|
275271 |
103814938 |
1 |
ON3C15H25 |
AB3C15D25 |
-38.38 |
5.17 |
-8.9 |
0.08 |
0 |
|
|
275272 |
103814939 |
1 |
ON3C12H25 |
AB3C12D25 |
-68.28 |
1.56 |
-8.62 |
1.01 |
0 |
|
|
275273 |
103814944 |
1 |
ON3C14H31 |
AB3C14D31 |
-89.84 |
4.38 |
-8.86 |
1.23 |
0 |
|
|
275274 |
103814949 |
1 |
ON3C15H25 |
AB3C15D25 |
-46.65 |
5.89 |
-8.51 |
0.06 |
0 |