List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199145 |
79204175 |
1 |
SN2O2C13H16 |
AB2C2D13E16 |
-64.06 |
3.33 |
-8.87 |
-0.58 |
0 |
|
|
199146 |
79204275 |
1 |
NO2C14H19 |
AB2C14D19 |
-94.29 |
4.55 |
-8.71 |
0.17 |
0 |
|
|
199147 |
79204633 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-131.67 |
3.19 |
-8.78 |
-0.23 |
0 |
|
|
199148 |
79204751 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-83.79 |
3.66 |
-9.01 |
-0.2 |
0 |
|
|
199149 |
79205448 |
1 |
ClNOSC14H18 |
ABCDE14F18 |
-46.56 |
2.84 |
-8.56 |
-0.04 |
0 |
|
|
199150 |
79205466 |
1 |
SO3H16C17 |
AB3C16D17 |
-84.59 |
4.16 |
-8.63 |
-0.34 |
0 |
|
|
199151 |
79205468 |
1 |
ClSO3H13C16 |
ABC3D13E16 |
-87.36 |
6.15 |
-8.78 |
-1.15 |
0 |
|
|
199152 |
79206268 |
1 |
NOSC18H21 |
ABCD18E21 |
0.09 |
3.06 |
-8.24 |
0.12 |
0 |
|
|
199153 |
79206890 |
1 |
BrNOSH12C14 |
ABCDE12F14 |
16.74 |
5.38 |
-8.59 |
-0.56 |
0 |
|
|
199154 |
79206918 |
1 |
ClNS2H14C16 |
ABC2D14E16 |
53.66 |
1.23 |
-8.9 |
-0.64 |
0 |
|
|
199155 |
79207943 |
2 |
NC7H13 |
AB7C13 |
8.99 |
1.83 |
-8.74 |
1.22 |
0 |
|
|
199156 |
79208158 |
1 |
O2N4C11H16 |
A2B4C11D16 |
-26.26 |
5.2 |
-9.06 |
-0.65 |
0 |
|
|
199157 |
79208159 |
2 |
N2O2C5H7 |
A2B2C5D7 |
-120.73 |
4.14 |
-9.45 |
-0.96 |
0 |
|
|
199158 |
79208393 |
1 |
ON2C13H24 |
AB2C13D24 |
-66.65 |
3.67 |
-9.56 |
0.75 |
0 |
|
|
199159 |
79208550 |
1 |
OF3N3H12C14 |
AB3C3D12E14 |
-133.45 |
4.72 |
-9.82 |
-1.29 |
0 |
|
|
199160 |
79208551 |
1 |
ON6C14H16 |
AB6C14D16 |
70.72 |
9.68 |
-9.42 |
-0.93 |
0 |
|
|
199161 |
79208552 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-31.47 |
3.94 |
-9.22 |
-0.48 |
0 |
|
|
199162 |
79208553 |
1 |
N2O2F3C14H15 |
A2B2C3D14E15 |
-197.23 |
3.72 |
-9.45 |
-0.33 |
0 |
|
|
199163 |
79208554 |
1 |
ON4C16H22 |
AB4C16D22 |
-3.95 |
4.14 |
-7.97 |
0.05 |
0 |
|
|
199164 |
79208555 |
1 |
BrClF2N2O2H12C13 |
ABC2D2E2F12G13 |
-152.17 |
2.54 |
-9.86 |
-1.1 |
0 |
|
|
199165 |
79208556 |
1 |
NO3C14H21 |
AB3C14D21 |
-133.32 |
3.53 |
-8.84 |
0.34 |
0 |
|
|
199166 |
79209192 |
1 |
ON2C12H18 |
AB2C12D18 |
-25.92 |
3.23 |
-10.24 |
0.64 |
0 |
|
|
199167 |
79209219 |
1 |
O3N4C11H14 |
A3B4C11D14 |
-65.4 |
5.19 |
-10.39 |
-0.32 |
0 |
|
|
199168 |
79209220 |
1 |
NO3C12H19 |
AB3C12D19 |
-143.8 |
6.69 |
-10.08 |
0.22 |
0 |
|
|
199169 |
79209331 |
1 |
OSN5C10H19 |
ABC5D10E19 |
-19.34 |
4.76 |
-8.46 |
0.0 |
0 |
|
|
199170 |
79209332 |
1 |
NS2O3C12H13 |
AB2C3D12E13 |
-74.74 |
6.54 |
-8.75 |
-1.24 |
0 |
|
|
199171 |
79209333 |
1 |
NO4C14H15 |
AB4C14D15 |
-125.95 |
6.77 |
-9.39 |
-0.18 |
0 |
|
|
199172 |
79209361 |
1 |
NSO3C15H15 |
ABC3D15E15 |
-94.34 |
6.93 |
-8.93 |
-0.45 |
0 |
|
|
199173 |
79209437 |
1 |
SN2O4C13H14 |
AB2C4D13E14 |
-135.73 |
9.56 |
-9.35 |
-1.04 |
0 |
|
|
199174 |
79209571 |
1 |
ClFNO3H13C14 |
ABCD3E13F14 |
-151.04 |
6.68 |
-9.84 |
-0.66 |
0 |
|
|
199175 |
79209849 |
1 |
ON2C16H18 |
AB2C16D18 |
42.5 |
4.2 |
-9.9 |
-0.26 |
0 |
|
|
199176 |
79210172 |
1 |
N2O2F3C10H17 |
A2B2C3D10E17 |
-258.17 |
4.97 |
-9.76 |
0.56 |
0 |
|
|
199177 |
79210277 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-96.66 |
5.8 |
-9.72 |
-0.58 |
0 |
|
|
199178 |
79210278 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-126.13 |
4.82 |
-9.75 |
-0.58 |
0 |
|
|
199179 |
79210279 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-122.48 |
1.26 |
-8.87 |
1.2 |
0 |
|
|
199180 |
79210280 |
1 |
FO3N4H11C12 |
AB3C4D11E12 |
-127.49 |
3.74 |
-10.22 |
-1.24 |
0 |
|
|
199181 |
79210281 |
1 |
BrO2N4C13H15 |
AB2C4D13E15 |
-10.48 |
4.1 |
-9.26 |
-0.42 |
0 |
|
|
199182 |
79210282 |
1 |
BrFN2O2H10C12 |
ABC2D2E10F12 |
-80.24 |
6.27 |
-9.16 |
-1.06 |
0 |
|
|
199183 |
79210517 |
1 |
ClON2C13H15 |
ABC2D13E15 |
-24.49 |
1.84 |
-8.84 |
-0.22 |
0 |
|
|
199184 |
79210518 |
1 |
FON2C13H15 |
ABC2D13E15 |
-61.2 |
1.32 |
-8.94 |
-0.15 |
0 |
|
|
199185 |
79210735 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-133.9 |
8.35 |
-9.54 |
0.48 |
0 |
|
|
199186 |
79210769 |
1 |
ON3C13H19 |
AB3C13D19 |
-20.21 |
0.81 |
-8.44 |
0.59 |
0 |
|
|
199187 |
79211208 |
1 |
ON3C16H19 |
AB3C16D19 |
20.1 |
4.26 |
-9.6 |
-0.94 |
0 |
|
|
199188 |
79211487 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-82.77 |
3.19 |
-9.59 |
0.72 |
0 |
|
|
199189 |
79212135 |
1 |
OSN2C17H18 |
ABC2D17E18 |
-0.34 |
3.8 |
-8.15 |
-0.43 |
0 |
|
|
199190 |
79212268 |
1 |
SN2O3C14H14 |
AB2C3D14E14 |
-63.92 |
3.45 |
-8.76 |
-0.64 |
0 |
|
|
199191 |
79212778 |
1 |
NSO4C13H15 |
ABC4D13E15 |
-160.27 |
6.21 |
-8.99 |
-0.55 |
0 |
|
|
199192 |
79212950 |
1 |
OSN2C16H22 |
ABC2D16E22 |
-32.63 |
3.1 |
-8.58 |
-0.14 |
0 |
|
|
199193 |
79213070 |
1 |
OSN3C15H15 |
ABC3D15E15 |
19.84 |
3.6 |
-8.72 |
-0.39 |
0 |
|
|
199194 |
79213071 |
1 |
NSO3C13H15 |
ABC3D13E15 |
-117.52 |
1.97 |
-8.7 |
-0.24 |
0 |