List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
449223 |
135296956 |
1 |
N3O5C27H27 |
A3B5C27D27 |
-34.25 |
10.62 |
-9.6 |
-1.4 |
0 |
|
|
449224 |
135296966 |
1 |
N2O3C11H22 |
A2B3C11D22 |
-138.23 |
2.88 |
-9.07 |
-0.12 |
0 |
|
|
449225 |
135296977 |
1 |
ClN2O6C24H29 |
AB2C6D24E29 |
-197.33 |
12.56 |
-9.51 |
-1.42 |
0 |
|
|
449226 |
135296980 |
1 |
F2N2O5H18C19 |
A2B2C5D18E19 |
-267.09 |
10.44 |
-9.63 |
-1.66 |
0 |
|
|
449227 |
135296986 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-95.77 |
10.4 |
-9.32 |
-1.45 |
0 |
|
|
449228 |
135296999 |
2 |
NO2C10H11 |
AB2C10D11 |
-124.1 |
15.22 |
-9.39 |
-1.32 |
0 |
|
|
449229 |
135297006 |
1 |
N2O6C31H38 |
A2B6C31D38 |
-178.25 |
13.33 |
-8.8 |
-0.87 |
0 |
|
|
449230 |
135297020 |
1 |
SN2F3O7C22H23 |
AB2C3D7E22F23 |
-377.62 |
7.22 |
-9.16 |
-1.93 |
0 |
|
|
449231 |
135297026 |
2 |
NC6H12 |
AB6C12 |
-28.91 |
1.32 |
-8.21 |
2.68 |
0 |
|
|
449232 |
135297054 |
1 |
FOSN5C23H32 |
ABCD5E23F32 |
-33.57 |
1.74 |
-8.25 |
0.04 |
0 |
|
|
449233 |
135297055 |
1 |
SF3N5C24H32 |
AB3C5D24E32 |
-113.61 |
4.86 |
-8.48 |
-0.08 |
0 |
|
|
449234 |
135297062 |
1 |
FOSN7C23H28 |
ABCD7E23F28 |
33.48 |
4.21 |
-8.16 |
-1.2 |
0 |
|
|
449235 |
135297072 |
1 |
FOSN6C23H27 |
ABCD6E23F27 |
4.55 |
5.17 |
-8.28 |
-0.85 |
0 |
|
|
449236 |
135297077 |
1 |
ClN3O4H24C26 |
AB3C4D24E26 |
20.28 |
10.17 |
-8.99 |
-1.14 |
0 |
|
|
449237 |
135297083 |
1 |
OSF3N5C24H28 |
ABC3D5E24F28 |
-112.65 |
5.39 |
-8.7 |
-0.84 |
0 |
|
|
449238 |
135297084 |
1 |
SO3N4C13H18 |
AB3C4D13E18 |
-37.44 |
5.86 |
-9.18 |
-0.25 |
0 |
|
|
449239 |
135297085 |
2 |
NC6H8 |
AB6C8 |
41.82 |
1.47 |
-8.94 |
0.29 |
0 |
|
|
449243 |
135297119 |
2 |
NO3C13H17 |
AB3C13D17 |
-196.3 |
16.96 |
-9.31 |
-1.11 |
0 |
|
|
449244 |
135297126 |
2 |
NO3C12H15 |
AB3C12D15 |
-203.29 |
13.39 |
-8.82 |
-0.9 |
0 |
|
|
449245 |
135297138 |
1 |
ClN2O4C20H23 |
AB2C4D20E23 |
-126.83 |
9.7 |
-9.17 |
-1.19 |
0 |
|
|
449246 |
135297139 |
1 |
ClN2O5C23H27 |
AB2C5D23E27 |
-163.04 |
12.21 |
-9.54 |
-1.45 |
0 |
|
|
449247 |
135297144 |
1 |
N2O5C29H32 |
A2B5C29D32 |
-124.84 |
11.79 |
-8.72 |
-0.91 |
0 |
|
|
449248 |
135297151 |
1 |
O2C11H16 |
A2B11C16 |
-50.79 |
1.44 |
-9.39 |
0.93 |
0 |
|
|
449249 |
135297161 |
1 |
N2O5C23H26 |
A2B5C23D26 |
-128.94 |
12.23 |
-8.78 |
-0.85 |
0 |
|
|
449250 |
135297167 |
1 |
IO2C8H9 |
AB2C8D9 |
-16.63 |
5.77 |
-10.16 |
-1.97 |
0 |
|
|
449251 |
135297172 |
1 |
NO4C13H27 |
AB4C13D27 |
-212.04 |
1.88 |
-8.87 |
0.31 |
0 |
|
|
449252 |
135297180 |
1 |
N7O8C45H57 |
A7B8C45D57 |
-311.95 |
1.7 |
-8.59 |
-0.22 |
0 |
|
|
449253 |
135297184 |
1 |
O3C7H14 |
A3B7C14 |
-116.47 |
2.11 |
-9.35 |
0.9 |
0 |
|
|
449254 |
135297186 |
1 |
S3C6H14 |
A3B6C14 |
-4.34 |
3.93 |
-8.3 |
0.48 |
0 |
|
|
449255 |
135297198 |
1 |
ClNO5C18H26 |
ABC5D18E26 |
-247.11 |
2.7 |
-8.83 |
-0.16 |
0 |
|
|
449256 |
135297201 |
1 |
FNOC13H20 |
ABCD13E20 |
-85.75 |
2.87 |
-8.93 |
0.17 |
0 |
|
|
449257 |
135297210 |
1 |
FN6H17C25 |
AB6C17D25 |
156.79 |
6.96 |
-8.77 |
-2.2 |
0 |
|
|
449258 |
135297213 |
1 |
FON7H24C29 |
ABC7D24E29 |
98.27 |
10.32 |
-8.7 |
-2.14 |
0 |
|
|
449259 |
135297214 |
1 |
FON7H22C32 |
ABC7D22E32 |
142.21 |
5.07 |
-8.66 |
-2.08 |
0 |
|
|
449260 |
135297223 |
1 |
FON7H26C31 |
ABC7D26E31 |
98.6 |
10.36 |
-8.7 |
-2.15 |
0 |
|
|
449261 |
135297224 |
1 |
FON7H24C29 |
ABC7D24E29 |
97.21 |
3.55 |
-8.86 |
-2.3 |
0 |
|
|
449262 |
135297229 |
1 |
FN7H26C33 |
AB7C26D33 |
179.99 |
3.99 |
-8.8 |
-2.24 |
0 |
|
|
449263 |
135297230 |
1 |
F3N7H24C30 |
A3B7C24D30 |
45.66 |
6.58 |
-8.8 |
-2.23 |
0 |
|
|
449264 |
135297239 |
1 |
FON6H27C31 |
ABC6D27E31 |
97.24 |
8.29 |
-8.73 |
-2.15 |
0 |
|
|
449265 |
135297248 |
1 |
FN6H17C25 |
AB6C17D25 |
156.78 |
4.39 |
-8.81 |
-2.26 |
0 |
|
|
449266 |
135297249 |
1 |
FON7H28C31 |
ABC7D28E31 |
113.58 |
10.32 |
-8.73 |
-2.18 |
0 |
|
|
449267 |
135297254 |
1 |
ClN2O3H33C37 |
AB2C3D33E37 |
13.5 |
4.11 |
-8.69 |
-0.26 |
0 |
|
|
449268 |
135297259 |
1 |
NSO6C29H29 |
ABC6D29E29 |
-144.95 |
4.18 |
-9.06 |
-1.37 |
0 |
|
|
449269 |
135297264 |
1 |
NO2H51C56 |
AB2C51D56 |
80.58 |
2.27 |
-7.97 |
-0.32 |
0 |
|
|
449270 |
135297272 |
1 |
NO2H37C40 |
AB2C37D40 |
33.57 |
2.28 |
-7.86 |
-0.2 |
0 |
|
|
449271 |
135297290 |
1 |
NO2H39C41 |
AB2C39D41 |
34.22 |
1.31 |
-7.73 |
-0.16 |
0 |
|
|
449272 |
135297295 |
1 |
BrH19C22 |
AB19C22 |
68.74 |
2.37 |
-9.0 |
-0.13 |
0 |
|
|
449273 |
135297301 |
2 |
N2H14C23 |
A2B14C23 |
244.56 |
2.9 |
-8.05 |
-0.9 |
0 |
|
|
449274 |
135297314 |
1 |
N2H36C51 |
A2B36C51 |
209.74 |
1.94 |
-7.94 |
-0.67 |
0 |
|
|
449275 |
135297316 |
2 |
N2H13C22 |
A2B13C22 |
239.34 |
2.76 |
-8.06 |
-1.11 |
0 |