List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
153189 |
56312341 |
1 |
ClO3N4C22H23 |
AB3C4D22E23 |
-60.36 |
3.76 |
-8.51 |
-1.4 |
0 |
|
|
153190 |
56312342 |
2 |
N2O2C13H17 |
A2B2C13D17 |
-135.3 |
5.79 |
-8.44 |
-0.35 |
0 |
|
|
153191 |
56312343 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-134.49 |
3.48 |
-8.72 |
-0.49 |
0 |
|
|
153192 |
56312344 |
1 |
SN4O5C23H30 |
AB4C5D23E30 |
-171.58 |
9.74 |
-8.58 |
-0.6 |
0 |
|
|
153193 |
56312345 |
1 |
N4O5C21H28 |
A4B5C21D28 |
-193.36 |
3.68 |
-8.44 |
-0.75 |
0 |
|
|
153194 |
56312346 |
1 |
N3O5C24H31 |
A3B5C24D31 |
-158.36 |
6.26 |
-8.44 |
-0.32 |
0 |
|
|
153195 |
56312347 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-118.4 |
7.41 |
-8.41 |
-0.2 |
0 |
|
|
153196 |
56312348 |
1 |
SO4N5C25H33 |
AB4C5D25E33 |
-100.01 |
8.52 |
-8.46 |
-0.72 |
0 |
|
|
153197 |
56312349 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-126.01 |
4.83 |
-8.71 |
-0.48 |
0 |
|
|
153198 |
56312351 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-135.74 |
6.58 |
-8.47 |
-0.24 |
0 |
|
|
153199 |
56312355 |
1 |
ClSN2O4C21H25 |
ABC2D4E21F25 |
-127.21 |
6.35 |
-8.51 |
-1.08 |
0 |
|
|
153200 |
56312356 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
4.53 |
6.36 |
-9.34 |
-0.93 |
0 |
|
|
153201 |
56312357 |
1 |
N2S2O4C19H24 |
A2B2C4D19E24 |
-97.65 |
0.9 |
-9.51 |
-1.27 |
0 |
|
|
153202 |
56312358 |
1 |
NSO4C19H23 |
ABC4D19E23 |
-134.42 |
3.62 |
-9.51 |
-0.99 |
0 |
|
|
153203 |
56312362 |
1 |
SN2O4C17H20 |
AB2C4D17E20 |
-55.36 |
5.09 |
-9.56 |
-1.86 |
0 |
|
|
153204 |
56312364 |
1 |
SN2F3O3C18H19 |
AB2C3D3E18F19 |
-236.48 |
4.33 |
-9.56 |
-1.27 |
0 |
|
|
153205 |
56312365 |
1 |
NSO4C19H19 |
ABC4D19E19 |
-106.02 |
4.48 |
-9.62 |
-1.45 |
0 |
|
|
153206 |
56312366 |
1 |
BrFNSO2C16H17 |
ABCDE2F16G17 |
-81.29 |
4.09 |
-9.41 |
-1.0 |
0 |
|
|
153207 |
56312367 |
1 |
FON4C22H25 |
ABC4D22E25 |
-26.82 |
3.39 |
-8.84 |
-0.28 |
0 |
|
|
153208 |
56312368 |
1 |
FSO2N3C23H24 |
ABC2D3E23F24 |
-61.26 |
4.81 |
-8.3 |
-0.77 |
0 |
|
|
153209 |
56312369 |
1 |
SO3N4C20H26 |
AB3C4D20E26 |
-79.06 |
9.51 |
-7.95 |
-0.74 |
0 |
|
|
153210 |
56312370 |
1 |
SO2N5C21H25 |
AB2C5D21E25 |
1.89 |
7.54 |
-8.3 |
-0.85 |
0 |
|
|
153211 |
56312371 |
1 |
SO2N3C25H27 |
AB2C3D25E27 |
-4.41 |
5.72 |
-8.33 |
-0.91 |
0 |
|
|
153212 |
56312372 |
1 |
SO3N4C24H32 |
AB3C4D24E32 |
-86.2 |
6.78 |
-8.68 |
-1.03 |
0 |
|
|
153213 |
56312373 |
1 |
FN2O2C18H19 |
AB2C2D18E19 |
-78.18 |
5.01 |
-9.03 |
-0.35 |
0 |
|
|
153214 |
56312374 |
1 |
FO2N3H18C20 |
AB2C3D18E20 |
-32.95 |
6.26 |
-9.07 |
-1.06 |
0 |
|
|
153215 |
56312376 |
1 |
FON2C21H25 |
ABC2D21E25 |
-38.32 |
4.92 |
-8.93 |
0.03 |
0 |
|
|
153216 |
56312377 |
1 |
O3N4C26H30 |
A3B4C26D30 |
-59.61 |
3.61 |
-8.65 |
-0.54 |
0 |
|
|
153217 |
56312378 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-91.28 |
5.02 |
-9.09 |
0.1 |
0 |
|
|
153218 |
56312379 |
1 |
FON2C22H27 |
ABC2D22E27 |
-33.23 |
2.72 |
-9.0 |
-0.07 |
0 |
|
|
153219 |
56312380 |
1 |
N2O3C22H26 |
A2B3C22D26 |
-51.8 |
3.43 |
-8.49 |
-0.18 |
0 |
|
|
153220 |
56312381 |
1 |
ClO2N3C20H24 |
AB2C3D20E24 |
-47.31 |
5.62 |
-8.59 |
-0.53 |
0 |
|
|
153221 |
56312382 |
1 |
N3O3C23H27 |
A3B3C23D27 |
-57.44 |
5.47 |
-8.4 |
-0.72 |
0 |
|
|
153222 |
56312383 |
1 |
FO2N3C24H26 |
AB2C3D24E26 |
-70.19 |
0.77 |
-8.22 |
-0.98 |
0 |
|
|
153223 |
56312384 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-43.69 |
5.32 |
-8.57 |
-0.78 |
0 |
|
|
153224 |
56312385 |
2 |
ON2C12H13 |
AB2C12D13 |
-0.36 |
4.85 |
-8.49 |
-0.89 |
0 |
|
|
153225 |
56312386 |
1 |
SN3O5C22H27 |
AB3C5D22E27 |
-168.49 |
1.83 |
-8.64 |
-1.04 |
0 |
|
|
153226 |
56312387 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-17.05 |
5.75 |
-8.44 |
-0.66 |
0 |
|
|
153227 |
56312388 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-133.84 |
8.65 |
-8.89 |
-0.41 |
0 |
|
|
153228 |
56312389 |
1 |
N3O5C24H31 |
A3B5C24D31 |
-171.15 |
2.93 |
-8.22 |
0.05 |
0 |
|
|
153229 |
56312390 |
1 |
N4O5C23H28 |
A4B5C23D28 |
-101.66 |
5.16 |
-8.77 |
-1.41 |
0 |
|
|
153230 |
56312391 |
1 |
SN4O4C21H26 |
AB4C4D21E26 |
-127.39 |
1.71 |
-8.66 |
-0.68 |
0 |
|
|
153231 |
56312393 |
3 |
NOC8H9 |
ABC8D9 |
-52.53 |
2.72 |
-8.84 |
-0.65 |
0 |
|
|
153232 |
56312394 |
1 |
N4O5C23H32 |
A4B5C23D32 |
-211.03 |
3.05 |
-8.72 |
-0.46 |
0 |
|
|
153233 |
56312395 |
1 |
O4N5C24H35 |
A4B5C24D35 |
-128.19 |
6.1 |
-9.24 |
-0.53 |
0 |
|
|
153234 |
56312396 |
1 |
ON4C26H30 |
AB4C26D30 |
41.0 |
6.53 |
-8.58 |
-0.48 |
0 |
|
|
153235 |
56312398 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-82.99 |
3.98 |
-8.46 |
0.14 |
0 |
|
|
153236 |
56312399 |
1 |
SO2N4C21H28 |
AB2C4D21E28 |
-59.46 |
4.35 |
-8.6 |
-0.21 |
0 |
|
|
153237 |
56312400 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-19.86 |
2.71 |
-9.16 |
-1.28 |
0 |
|
|
153238 |
56312401 |
1 |
O2N8C25H32 |
A2B8C25D32 |
10.59 |
0.83 |
-8.95 |
-0.62 |
0 |
|
|
153239 |
56312402 |
1 |
SO2N3C24H27 |
AB2C3D24E27 |
-11.41 |
4.93 |
-8.78 |
-0.87 |
0 |
|
|
153240 |
56312403 |
1 |
O3N4C27H36 |
A3B4C27D36 |
-101.31 |
5.66 |
-8.79 |
-0.01 |
0 |
|
|
153241 |
56312404 |
1 |
FO2N4C23H25 |
AB2C4D23E25 |
-32.36 |
2.16 |
-9.13 |
-0.87 |
0 |
|
|
153242 |
56312405 |
1 |
SO2N3C23H29 |
AB2C3D23E29 |
-56.68 |
2.59 |
-8.9 |
-0.4 |
0 |
|
|
153243 |
56312406 |
1 |
O2N3C29H33 |
A2B3C29D33 |
-24.65 |
6.76 |
-8.97 |
0.01 |
0 |
|
|
153244 |
56312407 |
1 |
F2N3O3C23H27 |
A2B3C3D23E27 |
-197.17 |
4.07 |
-9.13 |
-0.35 |
0 |
|
|
153245 |
56312408 |
1 |
N3O4C25H33 |
A3B4C25D33 |
-142.02 |
6.24 |
-8.5 |
0.01 |
0 |
|
|
153246 |
56312409 |
1 |
ClO3N4C24H29 |
AB3C4D24E29 |
-97.25 |
2.24 |
-8.99 |
-0.32 |
0 |
|
|
153247 |
56312410 |
1 |
SN3O4C23H31 |
AB3C4D23E31 |
-127.37 |
6.55 |
-9.01 |
-0.37 |
0 |
|
|
153248 |
56312411 |
1 |
O3N4C24H30 |
A3B4C24D30 |
-87.12 |
2.16 |
-8.94 |
-0.17 |
0 |
|
|
153249 |
56312415 |
1 |
O2N5C27H33 |
A2B5C27D33 |
-22.49 |
2.61 |
-8.5 |
-0.12 |
0 |
|
|
153250 |
56312416 |
1 |
O2N3C24H27 |
A2B3C24D27 |
-24.6 |
5.13 |
-8.67 |
-0.25 |
0 |
|
|
153251 |
56312417 |
1 |
O3N4C22H34 |
A3B4C22D34 |
-143.91 |
5.57 |
-9.08 |
0.02 |
0 |
|
|
153252 |
56312418 |
1 |
N3O4C27H35 |
A3B4C27D35 |
-133.69 |
4.21 |
-8.6 |
0.09 |
0 |
|
|
153253 |
56312421 |
1 |
FO2N3C24H30 |
AB2C3D24E30 |
-94.95 |
2.41 |
-8.9 |
-0.21 |
0 |
|
|
153254 |
56312423 |
1 |
ClN4O4C22H25 |
AB4C4D22E25 |
-62.67 |
10.03 |
-9.36 |
-1.56 |
0 |
|
|
153255 |
56312424 |
1 |
BrO2N3C22H26 |
AB2C3D22E26 |
-57.94 |
3.58 |
-8.81 |
-0.24 |
0 |
|
|
153256 |
56312425 |
1 |
O2N3C23H35 |
A2B3C23D35 |
-108.2 |
2.92 |
-9.01 |
0.3 |
0 |
|
|
153257 |
56312426 |
1 |
N2O3C26H28 |
A2B3C26D28 |
-82.19 |
5.82 |
-9.06 |
-1.04 |
0 |
|
|
153258 |
56312427 |
1 |
SO2N4C25H30 |
AB2C4D25E30 |
-32.28 |
5.03 |
-9.05 |
-0.73 |
0 |
|
|
153259 |
56312428 |
1 |
SO3N4C23H28 |
AB3C4D23E28 |
-98.13 |
4.5 |
-8.47 |
-0.51 |
0 |
|
|
153260 |
56312429 |
2 |
ON2C13H16 |
AB2C13D16 |
-35.52 |
5.43 |
-8.81 |
-0.04 |
0 |
|
|
153261 |
56312430 |
1 |
N3O3C25H33 |
A3B3C25D33 |
-94.24 |
5.05 |
-8.67 |
0.05 |
0 |
|
|
153262 |
56312431 |
1 |
ClSN2O3C21H25 |
ABC2D3E21F25 |
-94.16 |
3.48 |
-9.07 |
-1.0 |
0 |
|
|
153263 |
56312432 |
2 |
NO2C12H13 |
AB2C12D13 |
-114.21 |
5.04 |
-9.09 |
-0.95 |
0 |
|
|
153264 |
56312433 |
1 |
SO3N5C26H35 |
AB3C5D26E35 |
-71.07 |
8.0 |
-9.17 |
-0.69 |
0 |
|
|
153265 |
56312434 |
1 |
F2N3O3C22H25 |
A2B3C3D22E25 |
-193.29 |
4.81 |
-9.12 |
-0.5 |
0 |
|
|
153266 |
56312435 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-61.69 |
6.15 |
-9.28 |
-1.24 |
0 |
|
|
153267 |
56312436 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-53.47 |
5.15 |
-9.45 |
-1.17 |
0 |
|
|
153268 |
56312437 |
1 |
OSF2N5C22H23 |
ABC2D5E22F23 |
-28.83 |
4.46 |
-8.96 |
-1.47 |
0 |
|
|
153269 |
56312438 |
1 |
OF2N4C22H24 |
AB2C4D22E24 |
-24.05 |
1.39 |
-8.83 |
-0.91 |
0 |
|
|
153270 |
56312439 |
1 |
FO2N4C23H29 |
AB2C4D23E29 |
-99.17 |
3.18 |
-8.74 |
-0.09 |
0 |
|
|
153271 |
56312440 |
1 |
FN4O4C22H25 |
AB4C4D22E25 |
-147.86 |
3.47 |
-8.54 |
-0.43 |
0 |
|
|
153272 |
56312441 |
1 |
FON3Cl4C20H20 |
ABC3D4E20F20 |
-63.55 |
2.68 |
-8.8 |
-1.1 |
0 |
|
|
153273 |
56312442 |
1 |
FON3C22H28 |
ABC3D22E28 |
-48.01 |
3.51 |
-8.85 |
0.01 |
0 |
|
|
153274 |
56312443 |
1 |
FON3C22H28 |
ABC3D22E28 |
-53.88 |
3.84 |
-8.74 |
-0.01 |
0 |
|
|
153275 |
56312444 |
1 |
FON4C22H25 |
ABC4D22E25 |
-18.01 |
4.59 |
-8.76 |
-0.88 |
0 |
|
|
153276 |
56312448 |
1 |
N3O3C24H31 |
A3B3C24D31 |
-82.53 |
6.05 |
-8.8 |
-0.13 |
0 |
|
|
153277 |
56312449 |
1 |
N2O3C23H30 |
A2B3C23D30 |
-92.53 |
4.37 |
-8.74 |
0.14 |
0 |
|
|
153278 |
56312453 |
1 |
Cl2O2N3C19H21 |
A2B2C3D19E21 |
-43.12 |
1.31 |
-8.72 |
-0.94 |
0 |
|
|
153279 |
56312455 |
1 |
S2N3O4C25H29 |
A2B3C4D25E29 |
-92.47 |
7.63 |
-8.47 |
-1.32 |
0 |
|
|
153280 |
56312456 |
1 |
S2O3N4H20C22 |
A2B3C4D20E22 |
1.15 |
5.29 |
-8.62 |
-1.35 |
0 |
|
|
153281 |
56312457 |
1 |
FN3O5H24C27 |
AB3C5D24E27 |
-133.34 |
4.76 |
-8.61 |
-1.11 |
0 |
|
|
153282 |
56312458 |
1 |
FN4O4H21C23 |
AB4C4D21E23 |
-59.07 |
4.83 |
-9.35 |
-1.29 |
0 |
|
|
153283 |
56312459 |
1 |
BrFO2N4H16C22 |
ABC2D4E16F22 |
16.57 |
3.15 |
-9.36 |
-1.09 |
0 |
|
|
153284 |
56312460 |
1 |
BrF3N3O3H19C20 |
AB3C3D3E19F20 |
-207.89 |
6.44 |
-8.89 |
-1.08 |
0 |
|
|
153285 |
56312461 |
1 |
N2F3O5C25H29 |
A2B3C5D25E29 |
-311.11 |
7.35 |
-9.14 |
-0.38 |
0 |
|
|
153286 |
56312463 |
1 |
O2N3F6C13H17 |
A2B3C6D13E17 |
-386.1 |
3.03 |
-9.98 |
-0.56 |
0 |
|
|
153287 |
56312464 |
1 |
NO4F6C17H21 |
AB4C6D17E21 |
-477.8 |
5.36 |
-8.86 |
-0.22 |
0 |
|
|
153288 |
56312465 |
1 |
FN2O3C23H27 |
AB2C3D23E27 |
-114.32 |
4.98 |
-9.23 |
-0.98 |
0 |