List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
431214 |
135171284 |
1 |
O2N7C21H25 |
A2B7C21D25 |
42.92 |
7.94 |
-8.79 |
-0.98 |
0 |
|
|
431215 |
135171285 |
2 |
ON2C10H16 |
AB2C10D16 |
-39.51 |
4.26 |
-8.51 |
-0.2 |
0 |
|
|
431216 |
135171286 |
1 |
O2F3N5C19H24 |
A2B3C5D19E24 |
-186.1 |
4.56 |
-8.74 |
-0.36 |
0 |
|
|
431217 |
135171287 |
1 |
ClN3O3C20H22 |
AB3C3D20E22 |
-76.52 |
8.39 |
-9.11 |
-0.78 |
0 |
|
|
431218 |
135171288 |
1 |
O3N5C26H29 |
A3B5C26D29 |
-29.56 |
1.74 |
-8.76 |
-0.92 |
0 |
|
|
431219 |
135171289 |
1 |
OSN5C20H25 |
ABC5D20E25 |
31.37 |
4.3 |
-9.19 |
-0.73 |
0 |
|
|
431220 |
135171290 |
1 |
O4N5C26H31 |
A4B5C26D31 |
-68.24 |
3.3 |
-8.76 |
-0.84 |
0 |
|
|
431221 |
135171291 |
1 |
O2N5C23H29 |
A2B5C23D29 |
27.74 |
3.47 |
-9.21 |
-0.66 |
0 |
|
|
431222 |
135171292 |
1 |
O2N5C23H29 |
A2B5C23D29 |
26.22 |
1.19 |
-9.11 |
-0.69 |
0 |
|
|
431223 |
135171293 |
1 |
FN3O3H16C18 |
AB3C3D16E18 |
-88.25 |
4.27 |
-9.52 |
-1.04 |
0 |
|
|
431224 |
135171294 |
1 |
OSN5C20H25 |
ABC5D20E25 |
28.03 |
2.34 |
-9.16 |
-0.71 |
0 |
|
|
431225 |
135171295 |
1 |
ON5C24H31 |
AB5C24D31 |
6.91 |
5.99 |
-8.5 |
-0.43 |
0 |
|
|
431226 |
135171296 |
1 |
ON5C25H33 |
AB5C25D33 |
7.42 |
4.62 |
-8.17 |
-0.61 |
0 |
|
|
431227 |
135171297 |
1 |
PSO3N5C22H28 |
ABC3D5E22F28 |
-45.01 |
5.7 |
-8.05 |
-0.43 |
0 |
|
|
431232 |
135171302 |
1 |
BrN2O2C7H7 |
AB2C2D7E7 |
-37.86 |
3.28 |
-10.47 |
-1.61 |
0 |
|
|
431233 |
135171303 |
1 |
PSO2N5C19H20 |
ABC2D5E19F20 |
-20.95 |
6.22 |
-8.26 |
-0.74 |
0 |
|
|
431234 |
135171304 |
1 |
O3N5C27H31 |
A3B5C27D31 |
-34.03 |
3.17 |
-8.76 |
-0.85 |
0 |
|
|
431235 |
135171305 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-50.34 |
3.41 |
-8.62 |
-0.32 |
0 |
|
|
431236 |
135171307 |
1 |
IN2H3O3C5 |
AB2C3D3E5 |
-89.41 |
4.99 |
-9.97 |
-1.85 |
0 |
|
|
431237 |
135171308 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-43.2 |
1.35 |
-8.63 |
-0.73 |
0 |
|
|
431238 |
135171309 |
1 |
O2N3C11H13 |
A2B3C11D13 |
30.64 |
6.66 |
-9.34 |
-1.47 |
0 |
|
|
431239 |
135171310 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-52.31 |
3.4 |
-8.28 |
-0.46 |
0 |
|
|
431240 |
135171311 |
1 |
SO2N6C24H28 |
AB2C6D24E28 |
-2.56 |
12.22 |
-8.0 |
-1.07 |
0 |
|
|
431241 |
135171312 |
1 |
OSN5C21H27 |
ABC5D21E27 |
29.83 |
2.62 |
-8.87 |
-0.44 |
0 |
|
|
431242 |
135171313 |
1 |
O3N5C29H35 |
A3B5C29D35 |
-65.67 |
4.19 |
-9.22 |
-1.28 |
0 |
|
|
431243 |
135171314 |
1 |
OF2N3C24H27 |
AB2C3D24E27 |
-92.92 |
5.24 |
-8.84 |
-0.64 |
0 |
|
|
431244 |
135171315 |
1 |
FO2N4C25H27 |
AB2C4D25E27 |
-46.55 |
4.54 |
-9.06 |
-0.68 |
0 |
|
|
431245 |
135171316 |
1 |
FNOSC8H8 |
ABCDE8F8 |
-73.72 |
6.03 |
-8.43 |
-0.68 |
0 |
|
|
431246 |
135171317 |
1 |
ClSO2C10H13 |
ABC2D10E13 |
-87.82 |
3.89 |
-8.74 |
-0.63 |
0 |
|
|
431247 |
135171318 |
1 |
NSO2C10H13 |
ABC2D10E13 |
-77.69 |
2.66 |
-8.14 |
-0.14 |
0 |
|
|
431248 |
135171319 |
1 |
N2O2C21H34 |
A2B2C21D34 |
-108.77 |
4.06 |
-8.65 |
0.53 |
0 |
|
|
431249 |
135171320 |
1 |
FNSO3C8H8 |
ABCD3E8F8 |
-155.41 |
8.15 |
-10.28 |
-1.01 |
0 |
|
|
431250 |
135171321 |
1 |
ClOSC6H7 |
ABCD6E7 |
-34.53 |
4.71 |
-8.62 |
-0.76 |
0 |
|
|
431251 |
135171322 |
2 |
ON2C11H14 |
AB2C11D14 |
-3.68 |
6.89 |
-8.73 |
-0.19 |
0 |
|
|
431252 |
135171323 |
1 |
ON5C22H27 |
AB5C22D27 |
31.3 |
5.86 |
-9.2 |
-0.9 |
0 |
|
|
431253 |
135171324 |
1 |
ON5C22H27 |
AB5C22D27 |
29.07 |
4.81 |
-9.24 |
-1.03 |
0 |
|
|
431254 |
135171325 |
1 |
O2N3C25H29 |
A2B3C25D29 |
-32.48 |
3.35 |
-8.83 |
-0.45 |
0 |
|
|
431255 |
135171326 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-32.54 |
1.64 |
-8.36 |
-0.52 |
0 |
|
|
431256 |
135171327 |
1 |
ION3F4H8C15 |
ABC3D4E8F15 |
-114.12 |
5.75 |
-9.27 |
-1.47 |
0 |
|
|
431257 |
135171328 |
1 |
OF4N4H10C15 |
AB4C4D10E15 |
-138.33 |
5.97 |
-8.75 |
-1.16 |
0 |
|
|
431258 |
135171329 |
1 |
FN5C23H30 |
AB5C23D30 |
9.76 |
5.6 |
-8.11 |
-0.28 |
0 |
|
|
431259 |
135171330 |
1 |
SN6C20H24 |
AB6C20D24 |
90.17 |
9.08 |
-7.55 |
-0.56 |
0 |
|
|
431260 |
135171331 |
1 |
SO4C10H16 |
AB4C10D16 |
-197.71 |
4.97 |
-9.88 |
-0.57 |
0 |
|
|
431261 |
135171332 |
1 |
O2N4C27H28 |
A2B4C27D28 |
24.37 |
4.04 |
-8.88 |
-1.01 |
0 |
|
|
431262 |
135171333 |
1 |
OSN4C25H28 |
ABC4D25E28 |
31.84 |
1.48 |
-8.56 |
-0.63 |
0 |
|
|
431263 |
135171334 |
1 |
O2N4C27H28 |
A2B4C27D28 |
21.3 |
7.9 |
-9.12 |
-0.73 |
0 |
|
|
431264 |
135171335 |
1 |
OSN4C25H28 |
ABC4D25E28 |
35.74 |
2.45 |
-8.67 |
-0.65 |
1 |
|
|
431265 |
135171336 |
1 |
NS2O6C16H24 |
AB2C6D16E24 |
-236.27 |
8.29 |
0.0 |
0.0 |
0 |
|
|
431266 |
135171337 |
1 |
O2C15H26 |
A2B15C26 |
-113.35 |
1.37 |
-8.49 |
0.27 |
0 |
|
|
431267 |
135171338 |
1 |
FO2N5C24H32 |
AB2C5D24E32 |
-71.25 |
5.67 |
-8.57 |
-0.38 |
0 |
|
|
431268 |
135171339 |
2 |
NC7H7 |
AB7C7 |
57.63 |
1.28 |
-7.97 |
-0.23 |
0 |
|
|
431269 |
135171340 |
1 |
N2C9H12 |
A2B9C12 |
72.68 |
2.85 |
-9.14 |
-0.36 |
0 |
|
|
431270 |
135171341 |
1 |
ON4C18H22 |
AB4C18D22 |
10.9 |
6.52 |
-9.22 |
-0.86 |
0 |
|
|
431271 |
135171342 |
1 |
ON3F6H11C12 |
AB3C6D11E12 |
-318.14 |
3.09 |
-8.89 |
-1.36 |
0 |
|
|
431272 |
135171343 |
1 |
SN2O2F3H19C20 |
AB2C2D3E19F20 |
-172.66 |
4.83 |
-8.9 |
-1.42 |
0 |
|
|
431273 |
135171344 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-95.63 |
6.41 |
-9.59 |
-1.25 |
0 |
|
|
431274 |
135171345 |
1 |
O3N4C23H28 |
A3B4C23D28 |
-82.15 |
3.18 |
-9.25 |
-0.65 |
0 |
|
|
431275 |
135171346 |
1 |
N3O3C24H29 |
A3B3C24D29 |
-93.34 |
3.54 |
-8.78 |
-0.42 |
0 |
|
|
431276 |
135171347 |
1 |
O2N6H26C27 |
A2B6C26D27 |
67.13 |
3.58 |
-9.46 |
-1.34 |
0 |
|
|
431277 |
135171348 |
1 |
O2N6H26C27 |
A2B6C26D27 |
63.54 |
7.99 |
-9.33 |
-1.16 |
0 |
|
|
431278 |
135171349 |
1 |
ON5C17H21 |
AB5C17D21 |
22.87 |
5.67 |
-9.19 |
-1.33 |
0 |
|
|
431279 |
135171350 |
1 |
OF3N3C25H28 |
AB3C3D25E28 |
-159.16 |
6.51 |
-9.21 |
-0.73 |
0 |
|
|
431280 |
135171351 |
1 |
ClON4C15H17 |
ABC4D15E17 |
22.47 |
5.28 |
-9.25 |
-0.64 |
0 |
|
|
431281 |
135171352 |
1 |
ClN3O4C19H22 |
AB3C4D19E22 |
-111.28 |
6.3 |
-8.54 |
-0.64 |
0 |
|
|
431282 |
135171353 |
1 |
FON5C24H26 |
ABC5D24E26 |
0.64 |
3.1 |
-9.38 |
-0.86 |
0 |
|
|
431283 |
135171354 |
1 |
O2N5C23H25 |
A2B5C23D25 |
83.37 |
6.28 |
-9.13 |
-0.96 |
0 |
|
|
431284 |
135171355 |
1 |
OF3N3C25H28 |
AB3C3D25E28 |
-159.47 |
4.87 |
-8.7 |
-0.91 |
0 |
|
|
431285 |
135171356 |
1 |
ClO3N4C21H23 |
AB3C4D21E23 |
-68.39 |
8.78 |
-8.46 |
-0.66 |
0 |
|
|
431286 |
135171357 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-90.94 |
4.79 |
-8.43 |
-0.96 |
0 |
|
|
431287 |
135171358 |
1 |
ClON4C16H19 |
ABC4D16E19 |
11.47 |
4.45 |
-9.17 |
-0.48 |
0 |
|
|
431288 |
135171359 |
1 |
ClFO2N3C17H19 |
ABC2D3E17F19 |
-74.09 |
4.76 |
-8.41 |
-0.62 |
0 |
|
|
431289 |
135171360 |
1 |
SBr2O2N4C13H14 |
AB2C2D4E13F14 |
-12.38 |
7.2 |
-9.09 |
-1.11 |
0 |
|
|
431290 |
135171361 |
3 |
NC2H3 |
AB2C3 |
59.45 |
3.14 |
-8.48 |
-0.11 |
0 |
|
|
431291 |
135171362 |
1 |
O2N7C26H29 |
A2B7C26D29 |
110.08 |
5.23 |
-8.72 |
-0.82 |
0 |
|
|
431292 |
135171363 |
1 |
ClO2N4C20H23 |
AB2C4D20E23 |
-33.98 |
6.98 |
-9.1 |
-0.57 |
0 |