List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
314245 |
126621017 |
1 |
OSN3C4H11 |
ABC3D4E11 |
-1.32 |
3.51 |
-9.31 |
1.06 |
0 |
|
|
314246 |
126621019 |
1 |
NO2S2C3H7 |
AB2C2D3E7 |
-47.77 |
5.75 |
-8.63 |
-0.5 |
0 |
|
|
314247 |
126621021 |
1 |
ClSF3O4N6C20H20 |
ABC3D4E6F20G20 |
-212.98 |
4.46 |
-9.23 |
-1.58 |
0 |
|
|
314248 |
126621039 |
1 |
O3N5C26H31 |
A3B5C26D31 |
19.14 |
1.97 |
-8.71 |
-1.21 |
0 |
|
|
314249 |
126621041 |
1 |
SO4N6C27H30 |
AB4C6D27E30 |
-28.01 |
7.34 |
-8.49 |
-1.06 |
0 |
|
|
314250 |
126621049 |
1 |
SO4N6C27H28 |
AB4C6D27E28 |
-2.77 |
8.56 |
-8.32 |
-0.97 |
0 |
|
|
314251 |
126621051 |
1 |
ClSO3N5C19H24 |
ABC3D5E19F24 |
-39.45 |
3.35 |
-8.6 |
-1.41 |
0 |
|
|
314252 |
126621060 |
1 |
SO4N6H26C27 |
AB4C6D26E27 |
-22.45 |
5.81 |
-8.71 |
-1.27 |
0 |
|
|
314253 |
126621062 |
1 |
SO2N6H24C25 |
AB2C6D24E25 |
67.57 |
4.15 |
-8.57 |
-1.14 |
0 |
|
|
314254 |
126621064 |
1 |
NSC12H27 |
ABC12D27 |
-51.91 |
1.69 |
-8.46 |
0.92 |
0 |
|
|
314255 |
126621065 |
1 |
O2N6C29H32 |
A2B6C29D32 |
3.5 |
5.18 |
-8.31 |
-0.99 |
0 |
|
|
314256 |
126621066 |
1 |
SN2O3H18C22 |
AB2C3D18E22 |
-8.94 |
6.41 |
-8.71 |
-0.92 |
0 |
|
|
314257 |
126621067 |
2 |
N2C3H6 |
A2B3C6 |
58.84 |
3.75 |
-9.22 |
0.25 |
0 |
|
|
314258 |
126621069 |
1 |
N4C11H22 |
A4B11C22 |
33.06 |
4.61 |
-8.94 |
0.31 |
0 |
|
|
314259 |
126621070 |
1 |
NOC17H23 |
ABC17D23 |
-22.38 |
1.25 |
-7.92 |
0.04 |
0 |
|
|
314260 |
126621071 |
1 |
SO3N6C26H26 |
AB3C6D26E26 |
34.47 |
2.7 |
-8.49 |
-1.14 |
0 |
|
|
314261 |
126621072 |
1 |
SO4N6C27H28 |
AB4C6D27E28 |
-25.92 |
2.46 |
-8.4 |
-1.1 |
0 |
|
|
314262 |
126621074 |
1 |
SO4N6C29H32 |
AB4C6D29E32 |
-15.21 |
8.33 |
-8.46 |
-1.03 |
0 |
|
|
314263 |
126621079 |
1 |
ClSO2N4H11C14 |
ABC2D4E11F14 |
12.95 |
2.72 |
-9.11 |
-1.71 |
0 |
|
|
314264 |
126621081 |
1 |
ClSO2N5C18H18 |
ABC2D5E18F18 |
11.65 |
2.91 |
-8.94 |
-1.63 |
0 |
|
|
314265 |
126621086 |
1 |
ClSO4N5C19H22 |
ABC4D5E19F22 |
-74.88 |
4.17 |
-9.19 |
-1.53 |
0 |
|
|
314266 |
126621087 |
1 |
N3C11H13 |
A3B11C13 |
58.85 |
3.86 |
-8.57 |
-0.18 |
0 |
|
|
314267 |
126621090 |
4 |
OC8H13 |
AB8C13 |
-248.05 |
3.15 |
-8.67 |
0.47 |
0 |
|
|
314268 |
126621095 |
1 |
SC10H20 |
AB10C20 |
-45.13 |
2.16 |
-8.87 |
0.62 |
0 |
|
|
314269 |
126621096 |
1 |
ClO2N5H26C27 |
AB2C5D26E27 |
45.87 |
1.41 |
-9.01 |
-1.25 |
0 |
|
|
314270 |
126621117 |
1 |
SC14H22 |
AB14C22 |
-7.05 |
1.15 |
-8.74 |
0.14 |
0 |
|
|
314271 |
126621119 |
1 |
SC18H38 |
AB18C38 |
-88.22 |
2.11 |
-8.69 |
0.71 |
0 |
|
|
314274 |
126621126 |
1 |
O2S2N7C19H21 |
A2B2C7D19E21 |
34.79 |
7.25 |
-9.57 |
-0.86 |
0 |
|
|
314275 |
126621127 |
1 |
O2S2N8H26C27 |
A2B2C8D26E27 |
135.08 |
4.2 |
-9.71 |
-1.1 |
0 |
|
|
314276 |
126621128 |
1 |
N3O4F6H17C21 |
A3B4C6D17E21 |
-399.52 |
5.52 |
-8.87 |
-1.48 |
0 |
|
|
314277 |
126621132 |
1 |
O2S2N8H24C25 |
A2B2C8D24E25 |
104.36 |
7.21 |
-9.44 |
-0.8 |
0 |
|
|
314278 |
126621136 |
1 |
ON2F6H18C21 |
AB2C6D18E21 |
-291.23 |
5.27 |
-9.51 |
-1.43 |
0 |
|
|
314279 |
126621140 |
1 |
FO2S2N6C20H21 |
AB2C2D6E20F21 |
-20.23 |
7.62 |
-9.52 |
-1.12 |
0 |
|
|
314280 |
126621141 |
1 |
ISN2C5H7 |
ABC2D5E7 |
48.79 |
3.35 |
-9.86 |
-1.68 |
0 |
|
|
314281 |
126621142 |
2 |
N2O2F3C11H12 |
A2B2C3D11E12 |
-457.11 |
9.39 |
-10.06 |
-1.44 |
0 |
|
|
314282 |
126621146 |
1 |
NO3C9H15 |
AB3C9D15 |
-127.89 |
6.66 |
-8.11 |
0.1 |
0 |
|
|
314283 |
126621147 |
1 |
O2N3C9H11 |
A2B3C9D11 |
53.14 |
3.39 |
-9.24 |
-1.55 |
0 |
|
|
314284 |
126621149 |
1 |
N2O2F9H9C14 |
A2B2C9D9E14 |
-502.01 |
3.88 |
-9.91 |
-1.56 |
0 |
|
|
314285 |
126621150 |
1 |
N3O4F6H19C22 |
A3B4C6D19E22 |
-407.91 |
5.51 |
-8.83 |
-1.49 |
0 |
|
|
314286 |
126621152 |
2 |
NC5H9 |
AB5C9 |
9.43 |
0.27 |
-7.97 |
0.45 |
0 |
|
|
314287 |
126621154 |
1 |
NCl2O2F3H10C11 |
AB2C2D3E10F11 |
-233.62 |
1.89 |
-9.14 |
-0.7 |
0 |
|
|
314288 |
126621155 |
1 |
SC9H18 |
AB9C18 |
-21.69 |
2.08 |
-8.88 |
0.62 |
0 |
|
|
314289 |
126621156 |
1 |
NOSC18H33 |
ABCD18E33 |
-84.32 |
1.03 |
-8.46 |
0.82 |
0 |
|
|
314290 |
126621160 |
1 |
F3N3O5H20C24 |
A3B3C5D20E24 |
-274.59 |
4.64 |
-9.64 |
-1.04 |
0 |
|
|
314291 |
126621161 |
1 |
N4O4F7H11C19 |
A4B4C7D11E19 |
-359.31 |
5.92 |
-10.1 |
-1.96 |
0 |
|
|
314292 |
126621168 |
1 |
O3N4F6C19H20 |
A3B4C6D19E20 |
-382.22 |
6.1 |
-9.38 |
-1.41 |
0 |
|
|
314293 |
126621171 |
1 |
O2S2N8H26C27 |
A2B2C8D26E27 |
134.71 |
6.6 |
-9.7 |
-1.07 |
0 |
|
|
314294 |
126621180 |
1 |
ISN2O2F3H16C19 |
ABC2D2E3F16G19 |
-118.35 |
9.89 |
-8.36 |
-2.92 |
0 |
|
|
314295 |
126621200 |
1 |
N4O4F6C23H26 |
A4B4C6D23E26 |
-463.68 |
7.1 |
-10.04 |
-1.47 |
0 |
|
|
314296 |
126621217 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-10.28 |
5.41 |
-8.29 |
-0.32 |
0 |