List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
404136 |
135065114 |
1 |
N2O2C23H24 |
A2B2C23D24 |
-9.98 |
1.85 |
-8.67 |
-0.73 |
0 |
|
|
404137 |
135065115 |
1 |
N2O3C20H20 |
A2B3C20D20 |
-31.62 |
1.37 |
-8.78 |
-0.92 |
0 |
|
|
404138 |
135065116 |
1 |
N2O2H16C21 |
A2B2C16D21 |
32.44 |
4.67 |
-9.1 |
-0.85 |
0 |
|
|
404139 |
135065117 |
1 |
FO2N3H10C15 |
AB2C3D10E15 |
44.02 |
6.96 |
-9.18 |
-1.36 |
0 |
|
|
404140 |
135065118 |
1 |
F2N2H10C15 |
A2B2C10D15 |
3.69 |
4.12 |
-8.88 |
-0.84 |
0 |
|
|
404141 |
135065144 |
1 |
O2F3C18H25 |
A2B3C18D25 |
-257.72 |
5.39 |
-9.3 |
0.3 |
0 |
|
|
404142 |
135065175 |
1 |
PO2C16H17 |
AB2C16D17 |
-81.74 |
4.26 |
-9.19 |
-0.26 |
-4 |
|
|
404144 |
135065224 |
2 |
N8H29C44 |
A8B29C44 |
818.86 |
14.39 |
-8.97 |
-2.01 |
0 |
|
|
404145 |
135065225 |
1 |
NiN16H56C88 |
AB16C56D88 |
933.44 |
7.57 |
-7.55 |
-1.87 |
0 |
|
|
404146 |
135065226 |
1 |
CoF8H8N8C32 |
AB8C8D8E32 |
160.72 |
7.3 |
0.0 |
0.0 |
0 |
|
|
404147 |
135065227 |
2 |
F4N4H5C16 |
A4B4C5D16 |
-24.0 |
2.56 |
-8.18 |
-2.8 |
0 |
|
|
404148 |
135065228 |
1 |
NiF8H8N8C32 |
AB8C8D8E32 |
135.79 |
12.59 |
-8.09 |
-2.55 |
0 |
|
|
404149 |
135065229 |
1 |
ZnN8S8C80H112 |
AB8C8D80E112 |
180.69 |
3.41 |
-8.51 |
-1.66 |
0 |
|
|
404150 |
135065230 |
1 |
CuN8S8C80H112 |
AB8C8D80E112 |
298.73 |
7.64 |
0.0 |
0.0 |
0 |
|
|
404151 |
135065231 |
1 |
CuN8O8S8H64C88 |
AB8C8D8E64F88 |
372.71 |
7.98 |
0.0 |
0.0 |
0 |
|
|
404152 |
135065232 |
1 |
NiN8O8S8H64C88 |
AB8C8D8E64F88 |
654.77 |
17.55 |
-7.66 |
-3.77 |
2 |
|
|
404154 |
135065235 |
2 |
N4S4O12H33C44 |
A4B4C12D33E44 |
-251.75 |
16.03 |
-7.09 |
-2.13 |
0 |
|
|
404155 |
135065236 |
1 |
NiS8N16O16H72C88 |
AB8C16D16E72F88 |
299.55 |
8.62 |
-7.42 |
-3.53 |
0 |
|
|
404156 |
135065237 |
2 |
S4N8O8H37C44 |
A4B8C8D37E44 |
37.78 |
13.54 |
-7.37 |
-1.54 |
0 |
|
|
404157 |
135065238 |
1 |
ZnN8O24C80H96 |
AB8C24D80E96 |
-676.38 |
7.36 |
-8.5 |
-1.96 |
0 |
|
|
404158 |
135065239 |
1 |
MgN8O8C72H96 |
AB8C8D72E96 |
63.9 |
5.27 |
-7.5 |
-2.2 |
0 |
|
|
404160 |
135065242 |
1 |
BBrH6I6N6C24 |
ABC6D6E6F24 |
232.63 |
4.98 |
-8.4 |
-2.98 |
0 |
|
|
404161 |
135065243 |
1 |
BClN6O6C66H96 |
ABC6D6E66F96 |
-288.44 |
9.06 |
-7.59 |
-2.01 |
0 |
|
|
404162 |
135065244 |
1 |
ClN2O5C16H19 |
AB2C5D16E19 |
-149.52 |
3.75 |
-10.24 |
-2.12 |
0 |
|
|
404163 |
135065245 |
1 |
ClNO2C10H14 |
ABC2D10E14 |
-114.1 |
1.5 |
-10.15 |
0.29 |
0 |
|
|
404164 |
135065246 |
1 |
BrClNOH17C22 |
ABCDE17F22 |
45.13 |
2.13 |
-9.67 |
-0.75 |
0 |
|
|
404165 |
135065247 |
1 |
BrClNOH15C17 |
ABCDE15F17 |
7.98 |
2.11 |
-9.67 |
-0.73 |
0 |
|
|
404166 |
135065248 |
1 |
FeN2H18C20 |
AB2C18D20 |
147.6 |
5.81 |
-7.79 |
-0.62 |
0 |
|
|
404167 |
135065249 |
1 |
N2H13C15 |
A2B13C15 |
116.56 |
3.92 |
0.0 |
0.0 |
0 |
|
|
404168 |
135065250 |
1 |
FeN2H18C20 |
AB2C18D20 |
301.47 |
16.2 |
-6.32 |
-2.38 |
0 |
|
|
404169 |
135065251 |
1 |
ON2C17H22 |
AB2C17D22 |
46.18 |
1.91 |
-8.29 |
0.17 |
0 |
|
|
404170 |
135065252 |
1 |
ClON3H18C19 |
ABC3D18E19 |
47.64 |
1.78 |
-8.71 |
-0.71 |
0 |
|
|
404171 |
135065253 |
1 |
ClSO2N5H14C15 |
ABC2D5E14F15 |
13.77 |
4.08 |
-8.61 |
-0.72 |
0 |
|
|
404172 |
135065254 |
1 |
F2N4H16C17 |
A2B4C16D17 |
-6.6 |
3.66 |
-8.13 |
-0.3 |
0 |
|
|
404173 |
135065256 |
1 |
ON2H14C17 |
AB2C14D17 |
52.52 |
1.81 |
-9.49 |
-0.42 |
0 |
|
|
404174 |
135065300 |
1 |
NOF3C12H18 |
ABC3D12E18 |
-216.58 |
6.82 |
-10.52 |
0.21 |
0 |
|
|
404175 |
135065358 |
1 |
O4C15H20 |
A4B15C20 |
-168.41 |
1.91 |
-8.66 |
0.44 |
0 |
|
|
404176 |
135065359 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-79.76 |
4.52 |
-8.88 |
-0.16 |
0 |
|
|
404177 |
135065360 |
1 |
NSO4C15H17 |
ABC4D15E17 |
-123.33 |
3.62 |
-8.23 |
-0.19 |
0 |
|
|
404178 |
135065362 |
1 |
SO6C18H22 |
AB6C18D22 |
-220.69 |
5.78 |
-8.87 |
-0.02 |
0 |
|
|
404179 |
135065363 |
1 |
PO4H21C22 |
AB4C21D22 |
-139.44 |
3.41 |
-9.44 |
-0.15 |
0 |
|
|
404180 |
135065364 |
1 |
PO4C23H23 |
AB4C23D23 |
-149.66 |
4.5 |
-9.21 |
-0.14 |
0 |
|
|
404181 |
135065365 |
2 |
NOC8H10 |
ABC8D10 |
-44.15 |
0.65 |
-8.64 |
-0.12 |
0 |
|
|
404182 |
135065366 |
1 |
ClON2C15H17 |
ABC2D15E17 |
-14.76 |
2.65 |
-9.32 |
-0.3 |
0 |
|
|
404183 |
135065368 |
1 |
ClOC13H15 |
ABC13D15 |
-40.17 |
2.76 |
-9.36 |
-0.05 |
0 |
|
|
404184 |
135065369 |
1 |
NO5C14H17 |
AB5C14D17 |
-201.24 |
3.01 |
-9.62 |
0.05 |
0 |
|
|
404185 |
135065370 |
1 |
ClNO5C14H16 |
ABC5D14E16 |
-211.62 |
3.55 |
-9.53 |
-0.31 |
0 |
|
|
404186 |
135065371 |
1 |
NO5C15H19 |
AB5C15D19 |
-212.04 |
1.8 |
-9.24 |
0.22 |
0 |
|
|
404187 |
135065372 |
1 |
PF3O4H20C23 |
AB3C4D20E23 |
-303.18 |
7.26 |
-10.01 |
-0.61 |
0 |
|
|
404188 |
135065373 |
1 |
PO4C17H19 |
AB4C17D19 |
-175.84 |
4.08 |
-9.9 |
-0.25 |
0 |