List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
330181 |
127247168 |
1 |
O2N3C18H19 |
A2B3C18D19 |
-13.76 |
4.28 |
-9.18 |
-0.46 |
0 |
|
|
330182 |
127247169 |
1 |
ON5C17H19 |
AB5C17D19 |
41.13 |
2.8 |
-9.28 |
-0.49 |
0 |
|
|
330183 |
127247170 |
1 |
ON5C17H19 |
AB5C17D19 |
36.35 |
5.93 |
-9.1 |
-0.79 |
0 |
|
|
330184 |
127247171 |
1 |
ON6C16H18 |
AB6C16D18 |
68.8 |
3.82 |
-9.38 |
-0.78 |
0 |
|
|
330185 |
127247172 |
1 |
N6C17H24 |
A6B17C24 |
64.64 |
4.92 |
-8.62 |
0.11 |
0 |
|
|
330186 |
127247173 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-21.62 |
4.3 |
-9.44 |
-0.69 |
0 |
|
|
330187 |
127247174 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-48.76 |
4.42 |
-8.9 |
0.28 |
0 |
|
|
330188 |
127247175 |
1 |
ON5C17H25 |
AB5C17D25 |
-3.09 |
6.21 |
-9.28 |
0.37 |
0 |
|
|
330189 |
127247176 |
1 |
OSN3C17H21 |
ABC3D17E21 |
-1.56 |
4.96 |
-9.1 |
-0.39 |
0 |
|
|
330190 |
127247177 |
1 |
FO2N3C17H20 |
AB2C3D17E20 |
-77.99 |
4.39 |
-9.02 |
-0.05 |
0 |
|
|
330191 |
127247178 |
1 |
O2N5C16H23 |
A2B5C16D23 |
-15.28 |
5.65 |
-9.49 |
-0.25 |
0 |
|
|
330192 |
127247179 |
1 |
O2N5C16H23 |
A2B5C16D23 |
-30.49 |
3.22 |
-9.51 |
-0.15 |
0 |
|
|
330193 |
127247180 |
1 |
N5C19H21 |
A5B19C21 |
98.0 |
2.82 |
-9.29 |
-0.88 |
0 |
|
|
330194 |
127247181 |
1 |
ON6C17H18 |
AB6C17D18 |
66.53 |
3.73 |
-9.44 |
-0.68 |
0 |
|
|
330195 |
127247182 |
1 |
ON5C18H21 |
AB5C18D21 |
27.52 |
3.67 |
-8.85 |
-0.47 |
0 |
|
|
330196 |
127247183 |
1 |
SO2N5C14H21 |
AB2C5D14E21 |
-29.41 |
3.78 |
-9.19 |
0.06 |
0 |
|
|
330197 |
127247184 |
1 |
ON3C20H25 |
AB3C20D25 |
-16.52 |
5.58 |
-9.13 |
0.17 |
0 |
|
|
330198 |
127247185 |
1 |
ON6C17H20 |
AB6C17D20 |
60.24 |
3.06 |
-9.36 |
-0.61 |
0 |
|
|
330199 |
127247186 |
1 |
ON6C17H20 |
AB6C17D20 |
49.76 |
7.54 |
-9.29 |
-0.98 |
0 |
|
|
330200 |
127247187 |
1 |
O2N5C17H19 |
A2B5C17D19 |
24.81 |
6.76 |
-9.65 |
-1.15 |
0 |
|
|
330201 |
127247188 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-13.7 |
0.83 |
-8.84 |
0.09 |
0 |
|
|
330202 |
127247189 |
1 |
SN3O4C10H15 |
AB3C4D10E15 |
-138.98 |
4.29 |
-10.27 |
-0.34 |
0 |
|
|
330203 |
127247190 |
1 |
SO2N5C12H15 |
AB2C5D12E15 |
-5.32 |
3.87 |
-9.25 |
-0.69 |
0 |
|
|
330204 |
127247191 |
1 |
SO2N5C12H15 |
AB2C5D12E15 |
-8.98 |
5.35 |
-9.27 |
-0.44 |
0 |
|
|
330205 |
127247192 |
1 |
SO2N5C12H15 |
AB2C5D12E15 |
-6.02 |
7.38 |
-9.04 |
-0.49 |
0 |
|
|
330206 |
127247193 |
1 |
SN4O4C12H14 |
AB4C4D12E14 |
-63.49 |
4.22 |
-10.18 |
-1.13 |
0 |
|
|
330207 |
127247194 |
1 |
SN3O3C14H23 |
AB3C3D14E23 |
-107.12 |
6.2 |
-9.3 |
-0.12 |
0 |
|
|
330208 |
127247195 |
1 |
SO3N4C14H16 |
AB3C4D14E16 |
-55.88 |
6.61 |
-9.75 |
-0.95 |
0 |
|
|
330209 |
127247196 |
1 |
SO3N5C13H15 |
AB3C5D13E15 |
-41.55 |
2.62 |
-9.97 |
-1.39 |
0 |
|
|
330210 |
127247197 |
2 |
SN2O2C5H9 |
AB2C2D5E9 |
-130.41 |
6.34 |
-10.0 |
-0.33 |
0 |
|
|
330211 |
127247198 |
1 |
SO3N5C13H17 |
AB3C5D13E17 |
-49.38 |
1.44 |
-9.61 |
-0.09 |
0 |
|
|
330212 |
127247199 |
1 |
S2N3O3C13H15 |
A2B3C3D13E15 |
-61.96 |
5.83 |
-9.49 |
-0.93 |
0 |
|
|
330213 |
127247200 |
1 |
S2N3O3C13H15 |
A2B3C3D13E15 |
-60.53 |
2.82 |
-9.51 |
-0.68 |
0 |
|
|
330214 |
127247201 |
1 |
SN3O3C15H23 |
AB3C3D15E23 |
-117.79 |
3.15 |
-9.82 |
-0.12 |
0 |
|
|
330215 |
127247202 |
1 |
S2O3N4C12H14 |
A2B3C4D12E14 |
-48.1 |
6.8 |
-9.61 |
-1.19 |
0 |
|
|
330216 |
127247203 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
-65.54 |
2.95 |
-9.97 |
-0.49 |
0 |
|
|
330217 |
127247204 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
-67.17 |
1.91 |
-9.77 |
-0.75 |
0 |
|
|
330218 |
127247205 |
1 |
SO3N5C14H17 |
AB3C5D14E17 |
-52.82 |
7.03 |
-9.84 |
-1.15 |
0 |
|
|
330219 |
127247206 |
1 |
SO3N5C14H17 |
AB3C5D14E17 |
-57.1 |
2.38 |
-10.16 |
-1.17 |
0 |
|
|
330220 |
127247207 |
1 |
SO2N5C15H23 |
AB2C5D15E23 |
-23.41 |
4.48 |
-9.44 |
0.04 |
0 |
|
|
330221 |
127247208 |
1 |
SN4O4C14H18 |
AB4C4D14E18 |
-78.52 |
4.05 |
-10.06 |
-0.95 |
0 |
|
|
330222 |
127247209 |
1 |
S2N3O3C14H17 |
A2B3C3D14E17 |
-70.09 |
3.43 |
-9.18 |
-0.42 |
0 |
|
|
330223 |
127247210 |
1 |
S2N3O3C14H17 |
A2B3C3D14E17 |
-74.19 |
1.53 |
-9.37 |
-0.79 |
0 |
|
|
330224 |
127247211 |
1 |
S2O3N4C13H16 |
A2B3C4D13E16 |
-63.99 |
4.33 |
-9.68 |
-1.3 |
0 |
|
|
330225 |
127247212 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-55.15 |
2.13 |
-9.57 |
-0.77 |
0 |
|
|
330226 |
127247213 |
1 |
S2N3O4C13H21 |
A2B3C4D13E21 |
-143.83 |
7.66 |
-9.93 |
-0.15 |
0 |
|
|
330227 |
127247214 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-104.68 |
3.28 |
-9.3 |
-0.15 |
0 |
|
|
330228 |
127247215 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-110.97 |
10.39 |
-9.67 |
-0.68 |
0 |
|
|
330229 |
127247216 |
1 |
SN4O4C15H18 |
AB4C4D15E18 |
-104.51 |
4.08 |
-9.85 |
-0.99 |
0 |
|
|
330230 |
127247217 |
1 |
SN4O4C15H18 |
AB4C4D15E18 |
-103.37 |
3.78 |
-9.83 |
-0.86 |
0 |
|
|
330231 |
127247218 |
1 |
FSN3O3C16H18 |
ABC3D3E16F18 |
-122.66 |
3.89 |
-9.76 |
-0.24 |
0 |
|
|
330232 |
127247219 |
1 |
FSN3O3C16H18 |
ABC3D3E16F18 |
-124.8 |
4.28 |
-9.91 |
-0.36 |
0 |
|
|
330233 |
127247220 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-69.6 |
4.55 |
-9.41 |
-0.18 |
0 |
|
|
330234 |
127247221 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-63.86 |
3.6 |
-9.91 |
-0.32 |
0 |
|
|
330235 |
127247222 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-69.73 |
4.31 |
-9.44 |
-0.27 |
0 |
|
|
330236 |
127247223 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-61.76 |
1.15 |
-9.6 |
-0.06 |
0 |
|
|
330237 |
127247224 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-66.49 |
7.65 |
-9.53 |
-0.02 |
0 |
|
|
330238 |
127247225 |
1 |
SN4O4C15H20 |
AB4C4D15E20 |
-97.06 |
4.81 |
-9.96 |
-0.26 |
0 |
|
|
330239 |
127247226 |
1 |
SO3N6C14H20 |
AB3C6D14E20 |
-51.27 |
3.68 |
-10.24 |
-0.36 |
0 |
|
|
330240 |
127247227 |
1 |
S2N3O3C15H19 |
A2B3C3D15E19 |
-82.76 |
3.41 |
-9.49 |
-0.37 |
0 |
|
|
330241 |
127247228 |
1 |
S2O3N4C14H18 |
A2B3C4D14E18 |
-74.21 |
2.85 |
-9.52 |
-0.69 |
0 |
|
|
330242 |
127247229 |
1 |
S2N4O4C13H16 |
A2B4C4D13E16 |
-94.49 |
6.77 |
-10.19 |
-1.28 |
0 |
|
|
330243 |
127247230 |
1 |
SO2N4C18H22 |
AB2C4D18E22 |
-13.23 |
7.74 |
-8.41 |
-0.06 |
0 |
|
|
330244 |
127247231 |
1 |
SO3N5C16H17 |
AB3C5D16E17 |
-30.73 |
2.4 |
-9.27 |
-0.81 |
0 |
|
|
330245 |
127247232 |
1 |
S2O4N5C12H17 |
A2B4C5D12E17 |
-97.9 |
10.96 |
-9.75 |
-0.26 |
0 |
|
|
330246 |
127247233 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-55.04 |
2.71 |
-9.71 |
-0.2 |
0 |
|
|
330247 |
127247234 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-54.77 |
2.98 |
-8.55 |
-0.33 |
0 |
|
|
330248 |
127247235 |
1 |
SO2N5C17H21 |
AB2C5D17E21 |
-5.31 |
6.98 |
-9.08 |
-0.34 |
0 |
|
|
330249 |
127247236 |
1 |
ON4C14H18 |
AB4C14D18 |
13.07 |
3.22 |
-9.2 |
0.02 |
0 |
|
|
330250 |
127247237 |
1 |
ON5C13H17 |
AB5C13D17 |
29.6 |
7.23 |
-9.61 |
-0.16 |
0 |
|
|
330251 |
127247238 |
2 |
ON2C7H9 |
AB2C7D9 |
5.26 |
5.46 |
-9.78 |
-0.76 |
0 |
|
|
330252 |
127247239 |
1 |
OSN3C14H17 |
ABC3D14E17 |
15.35 |
6.25 |
-9.1 |
-0.13 |
0 |
|
|
330253 |
127247240 |
1 |
OSN3C14H17 |
ABC3D14E17 |
10.03 |
5.67 |
-9.21 |
-0.61 |
0 |
|
|
330254 |
127247241 |
1 |
OSN3C14H17 |
ABC3D14E17 |
7.83 |
6.24 |
-9.36 |
-0.58 |
0 |
|
|
330255 |
127247242 |
1 |
OSN3C14H17 |
ABC3D14E17 |
9.92 |
5.92 |
-9.13 |
-0.66 |
0 |