List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
347310 |
127272104 |
1 |
SO2N4C20H30 |
AB2C4D20E30 |
-26.46 |
3.0 |
-8.87 |
-1.11 |
0 |
|
|
347311 |
127272105 |
1 |
O3N4C21H38 |
A3B4C21D38 |
-160.48 |
5.23 |
-8.93 |
0.86 |
0 |
|
|
347312 |
127272106 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-106.91 |
5.63 |
-9.04 |
0.04 |
0 |
|
|
347313 |
127272107 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-93.69 |
4.73 |
-8.81 |
0.16 |
0 |
|
|
347314 |
127272108 |
2 |
ON2C10H17 |
AB2C10D17 |
-70.15 |
5.87 |
-8.98 |
0.89 |
0 |
|
|
347315 |
127272109 |
1 |
N3O3C19H35 |
A3B3C19D35 |
-163.58 |
2.37 |
-8.85 |
1.24 |
0 |
|
|
347316 |
127272110 |
1 |
OS3N5C13H17 |
AB3C5D13E17 |
29.71 |
6.79 |
-8.3 |
-0.9 |
0 |
|
|
347317 |
127272111 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-166.97 |
11.6 |
-9.08 |
-0.29 |
0 |
|
|
347318 |
127272112 |
1 |
OSN7C16H17 |
ABC7D16E17 |
91.33 |
10.32 |
-9.16 |
-1.04 |
0 |
|
|
347319 |
127272113 |
1 |
SO2N4C19H22 |
AB2C4D19E22 |
-36.02 |
6.09 |
-8.1 |
-0.61 |
0 |
|
|
347320 |
127272159 |
1 |
ON4C19H28 |
AB4C19D28 |
-40.64 |
6.16 |
-8.9 |
-0.27 |
0 |
|
|
347321 |
127272160 |
1 |
SO3N5C14H23 |
AB3C5D14E23 |
-112.0 |
2.96 |
-9.08 |
-0.47 |
0 |
|
|
347322 |
127272161 |
1 |
ON5C20H33 |
AB5C20D33 |
-48.39 |
4.36 |
-8.96 |
-0.41 |
0 |
|
|
347323 |
127272162 |
1 |
SO2N3C22H29 |
AB2C3D22E29 |
-55.81 |
3.02 |
-8.63 |
-0.66 |
0 |
|
|
347324 |
127272173 |
1 |
SO2N4C19H20 |
AB2C4D19E20 |
-12.17 |
4.97 |
-8.5 |
-0.66 |
0 |
|
|
347325 |
127272174 |
1 |
SO3N4C19H24 |
AB3C4D19E24 |
-81.53 |
4.31 |
-8.46 |
-0.62 |
0 |
|
|
347326 |
127272175 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-28.97 |
2.48 |
-8.78 |
-0.7 |
0 |
|
|
347327 |
127272176 |
1 |
SN3O3C16H21 |
AB3C3D16E21 |
-95.83 |
0.86 |
-8.65 |
-0.75 |
0 |
|
|
347328 |
127272177 |
1 |
SN3O3C16H21 |
AB3C3D16E21 |
-100.14 |
3.14 |
-8.73 |
-0.88 |
0 |
|
|
347329 |
127272178 |
1 |
SO2N6C18H20 |
AB2C6D18E20 |
24.08 |
6.09 |
-8.93 |
-0.83 |
0 |
|
|
347330 |
127272179 |
2 |
OSN2C9H10 |
ABC2D9E10 |
-6.78 |
3.75 |
-8.36 |
-0.63 |
0 |
|
|
347331 |
127272180 |
1 |
SN3O3C20H27 |
AB3C3D20E27 |
-100.03 |
3.6 |
-8.38 |
-0.57 |
0 |
|
|
347332 |
127272181 |
1 |
F2O2N3C18H25 |
A2B2C3D18E25 |
-183.07 |
5.4 |
-8.53 |
0.19 |
0 |
|
|
347333 |
127272182 |
1 |
SO2N4C15H24 |
AB2C4D15E24 |
-59.28 |
3.41 |
-8.91 |
-0.55 |
0 |
|
|
347334 |
127272183 |
1 |
SO2N3C18H29 |
AB2C3D18E29 |
-89.21 |
1.7 |
-9.37 |
-0.52 |
0 |
|
|
347335 |
127272184 |
1 |
OSN5C19H23 |
ABC5D19E23 |
24.19 |
8.07 |
-8.73 |
-0.72 |
0 |
|
|
347336 |
127272185 |
1 |
OSN6C14H20 |
ABC6D14E20 |
23.0 |
5.1 |
-9.43 |
-0.7 |
0 |
|
|
347337 |
127272186 |
1 |
SO2N4C16H24 |
AB2C4D16E24 |
-79.07 |
5.65 |
-9.49 |
-0.61 |
0 |
|
|
347338 |
127272187 |
1 |
OSN6C15H20 |
ABC6D15E20 |
31.97 |
6.49 |
-9.46 |
-0.7 |
0 |
|
|
347339 |
127272188 |
3 |
NOC6H11 |
ABC6D11 |
-163.11 |
4.13 |
-8.84 |
1.38 |
0 |
|
|
347340 |
127272189 |
1 |
SN3O4C17H31 |
AB3C4D17E31 |
-201.57 |
5.21 |
-9.03 |
0.67 |
0 |
|
|
347341 |
127272190 |
1 |
O3N4C20H36 |
A3B4C20D36 |
-171.81 |
4.57 |
-8.77 |
0.81 |
0 |
|
|
347342 |
127272191 |
1 |
O2N3C14H27 |
A2B3C14D27 |
-111.91 |
4.39 |
-8.86 |
1.28 |
0 |
|
|
347343 |
127272192 |
1 |
O2N3C13H25 |
A2B3C13D25 |
-112.6 |
4.79 |
-8.91 |
1.22 |
0 |
|
|
347344 |
127272193 |
1 |
O2N6C19H32 |
A2B6C19D32 |
-63.08 |
4.26 |
-9.03 |
0.35 |
0 |
|
|
347345 |
127272194 |
1 |
SO2N4C20H32 |
AB2C4D20E32 |
-72.41 |
4.89 |
-8.54 |
-0.6 |
0 |
|
|
347346 |
127272195 |
1 |
SO2N3C18H21 |
AB2C3D18E21 |
-39.96 |
2.52 |
-8.94 |
-0.58 |
0 |
|
|
347347 |
127272196 |
1 |
OSN5C17H19 |
ABC5D17E19 |
38.88 |
6.06 |
-9.14 |
-0.75 |
0 |
|
|
347348 |
127272197 |
1 |
SN3O3C19H23 |
AB3C3D19E23 |
-76.4 |
4.61 |
-8.75 |
-0.54 |
0 |
|
|
347349 |
127272198 |
1 |
OSN6C17H24 |
ABC6D17E24 |
16.16 |
5.03 |
-9.31 |
-0.53 |
0 |
|
|
347350 |
127272199 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-15.02 |
3.55 |
-8.99 |
-0.61 |
0 |
|
|
347351 |
127272200 |
1 |
SO2N4C17H22 |
AB2C4D17E22 |
-62.24 |
4.86 |
-9.12 |
-0.45 |
0 |
|
|
347352 |
127272201 |
1 |
OS2N5C15H17 |
AB2C5D15E17 |
46.85 |
6.15 |
-9.06 |
-0.81 |
0 |
|
|
347353 |
127272202 |
1 |
OSN6C17H20 |
ABC6D17E20 |
50.54 |
5.93 |
-9.05 |
-0.71 |
0 |
|
|
347354 |
127272203 |
1 |
SO2N4C21H26 |
AB2C4D21E26 |
-43.28 |
3.84 |
-9.48 |
-0.63 |
0 |
|
|
347355 |
127272204 |
1 |
S2N3O3C18H21 |
A2B3C3D18E21 |
-80.22 |
3.8 |
-9.34 |
-0.74 |
0 |
|
|
347356 |
127272205 |
1 |
OS2N4C14H18 |
AB2C4D14E18 |
8.23 |
2.68 |
-9.24 |
-0.59 |
0 |
|
|
347357 |
127272206 |
1 |
SO2N4C19H32 |
AB2C4D19E32 |
-83.88 |
5.59 |
-8.76 |
-0.62 |
0 |
|
|
347358 |
127272207 |
1 |
OSN6C18H26 |
ABC6D18E26 |
9.11 |
4.87 |
-9.02 |
-0.44 |
0 |
|
|
347359 |
127272208 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-66.13 |
4.87 |
-8.88 |
-0.61 |
0 |
|
|
347360 |
127272209 |
1 |
S2O3N4C15H24 |
A2B3C4D15E24 |
-115.38 |
5.96 |
-9.42 |
-0.61 |
0 |
|
|
347361 |
127272210 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-64.34 |
1.22 |
-9.18 |
-0.55 |
0 |
|
|
347362 |
127272211 |
1 |
OSN5C20H27 |
ABC5D20E27 |
4.18 |
3.37 |
-8.53 |
-0.58 |
0 |
|
|
347363 |
127272212 |
1 |
OS2N4C15H20 |
AB2C4D15E20 |
4.26 |
4.23 |
-9.04 |
-0.52 |
0 |
|
|
347364 |
127272213 |
1 |
ClOSN5C17H18 |
ABCD5E17F18 |
31.18 |
4.65 |
-9.27 |
-1.09 |
0 |
|
|
347365 |
127272214 |
1 |
SO2N4C19H32 |
AB2C4D19E32 |
-81.05 |
3.99 |
-8.87 |
-0.55 |
0 |
|
|
347366 |
127272215 |
1 |
OSN4C16H20 |
ABC4D16E20 |
12.17 |
4.64 |
-9.24 |
-0.64 |
0 |
|
|
347367 |
127272216 |
1 |
SO2N4C18H28 |
AB2C4D18E28 |
-87.92 |
3.34 |
-9.38 |
-0.62 |
0 |
|
|
347368 |
127272217 |
1 |
OSN5C20H27 |
ABC5D20E27 |
4.66 |
4.67 |
-9.03 |
-0.6 |
0 |
|
|
347369 |
127272218 |
1 |
SO2N5C19H25 |
AB2C5D19E25 |
-28.87 |
5.0 |
-8.62 |
-0.68 |
0 |
|
|
347370 |
127272219 |
1 |
OSN5C21H29 |
ABC5D21E29 |
5.53 |
6.41 |
-8.16 |
-0.53 |
0 |
|
|
347371 |
127272220 |
1 |
OSN5C20H27 |
ABC5D20E27 |
6.47 |
4.79 |
-8.32 |
-0.53 |
0 |
|
|
347372 |
127272221 |
1 |
OSN3C19H19 |
ABC3D19E19 |
19.4 |
5.27 |
-8.37 |
-0.52 |
0 |
|
|
347373 |
127272222 |
1 |
OSN3C19H19 |
ABC3D19E19 |
15.6 |
5.79 |
-8.51 |
-0.59 |
0 |
|
|
347374 |
127272223 |
1 |
OSN3C18H19 |
ABC3D18E19 |
4.77 |
4.71 |
-8.36 |
-0.37 |
0 |
|
|
347375 |
127272224 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-119.37 |
1.49 |
-8.79 |
-0.02 |
0 |
|
|
347376 |
127272225 |
1 |
SO2N3C18H21 |
AB2C3D18E21 |
-56.11 |
2.56 |
-8.49 |
-0.23 |
0 |
|
|
347377 |
127272226 |
1 |
SO3N4C18H22 |
AB3C4D18E22 |
-75.52 |
3.59 |
-9.06 |
-0.64 |
0 |
|
|
347378 |
127272227 |
2 |
NOC10H11 |
ABC10D11 |
-61.92 |
3.39 |
-8.6 |
0.17 |
0 |
|
|
347379 |
127272228 |
1 |
N2O4C21H22 |
A2B4C21D22 |
-127.07 |
3.3 |
-8.4 |
-0.12 |
0 |
|
|
347380 |
127272229 |
1 |
N3O3C20H21 |
A3B3C20D21 |
-89.43 |
7.67 |
-8.27 |
-0.16 |
0 |
|
|
347381 |
127272230 |
2 |
NO2C11H12 |
AB2C11D12 |
-134.21 |
3.43 |
-8.31 |
-0.2 |
0 |
|
|
347382 |
127272231 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-55.01 |
5.62 |
-8.67 |
-0.11 |
0 |
|
|
347383 |
127272232 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-88.42 |
5.67 |
-9.09 |
-0.29 |
0 |
|
|
347384 |
127272233 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
-5.46 |
4.41 |
-8.77 |
-0.66 |
0 |