List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
235314 |
92309396 |
1 |
SO3N5C18H23 |
AB3C5D18E23 |
-75.8 |
3.05 |
-8.22 |
-0.99 |
0 |
|
|
235315 |
92309397 |
1 |
SO3N5C18H23 |
AB3C5D18E23 |
-74.88 |
6.72 |
-8.86 |
-1.22 |
0 |
|
|
235316 |
92309399 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-60.06 |
2.67 |
-9.0 |
-0.68 |
0 |
|
|
235317 |
92309400 |
1 |
ClN3O3C16H18 |
AB3C3D16E18 |
-91.19 |
1.74 |
-9.52 |
-1.01 |
0 |
|
|
235318 |
92309401 |
1 |
ClN3O3C16H18 |
AB3C3D16E18 |
-91.85 |
3.44 |
-9.46 |
-0.95 |
0 |
|
|
235319 |
92309402 |
1 |
ClO2N3H18C19 |
AB2C3D18E19 |
-22.88 |
1.52 |
-9.5 |
-0.99 |
0 |
|
|
235320 |
92309403 |
1 |
ClO2N3H18C19 |
AB2C3D18E19 |
-24.27 |
3.56 |
-9.42 |
-1.19 |
0 |
|
|
235321 |
92309407 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-29.01 |
2.53 |
-9.02 |
-0.69 |
0 |
|
|
235322 |
92309409 |
1 |
ClO2N3H20C21 |
AB2C3D20E21 |
-29.06 |
2.64 |
-9.45 |
-0.99 |
0 |
|
|
235323 |
92309410 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-57.52 |
1.45 |
-9.57 |
-1.02 |
0 |
|
|
235324 |
92309411 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-60.14 |
1.92 |
-9.49 |
-0.97 |
0 |
|
|
235325 |
92309413 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-72.88 |
2.33 |
-9.0 |
-0.68 |
0 |
|
|
235326 |
92309416 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-77.19 |
4.96 |
-9.1 |
-0.8 |
0 |
|
|
235327 |
92309434 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-28.62 |
5.16 |
-9.0 |
-0.56 |
0 |
|
|
235328 |
92309438 |
1 |
OSN3C23H27 |
ABC3D23E27 |
-3.37 |
6.54 |
-8.46 |
-0.51 |
0 |
|
|
235329 |
92309442 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-148.89 |
4.01 |
-9.03 |
-0.71 |
0 |
|
|
235330 |
92309443 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-149.5 |
5.05 |
-9.06 |
-0.74 |
0 |
|
|
235331 |
92309448 |
1 |
ClOSN3C21H22 |
ABCD3E21F22 |
0.97 |
4.37 |
-8.97 |
-0.65 |
0 |
|
|
235332 |
92309449 |
1 |
ClOSN3C21H22 |
ABCD3E21F22 |
4.43 |
2.07 |
-9.04 |
-0.65 |
0 |
|
|
235333 |
92309450 |
1 |
ClOSN3C21H22 |
ABCD3E21F22 |
1.61 |
4.55 |
-8.76 |
-0.64 |
0 |
|
|
235334 |
92309452 |
1 |
SO2N3C23H27 |
AB2C3D23E27 |
-33.17 |
7.29 |
-8.25 |
-0.48 |
0 |
|
|
235335 |
92309460 |
1 |
SN3O3C23H25 |
AB3C3D23E25 |
-73.44 |
9.04 |
-8.69 |
-0.66 |
0 |
|
|
235336 |
92309461 |
1 |
SN3O3C23H25 |
AB3C3D23E25 |
-71.26 |
3.22 |
-9.06 |
-0.77 |
0 |
|
|
235337 |
92309463 |
1 |
ClFOSN3C21H21 |
ABCDE3F21G21 |
-40.74 |
3.38 |
-9.01 |
-0.78 |
0 |
|
|
235338 |
92309466 |
1 |
ClOSN3C22H24 |
ABCD3E22F24 |
-1.49 |
6.34 |
-8.75 |
-0.67 |
0 |
|
|
235339 |
92309472 |
1 |
OSN3C23H27 |
ABC3D23E27 |
-3.95 |
2.91 |
-8.5 |
-0.6 |
0 |
|
|
235340 |
92309479 |
1 |
OSN3C22H25 |
ABC3D22E25 |
14.87 |
3.49 |
-9.06 |
-0.58 |
0 |
|
|
235341 |
92309482 |
1 |
SO2N3C19H27 |
AB2C3D19E27 |
-61.75 |
5.77 |
-8.68 |
-0.53 |
0 |
|
|
235342 |
92309484 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-26.04 |
7.63 |
-8.3 |
-0.5 |
0 |
|
|
235343 |
92309491 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-97.42 |
2.67 |
-8.91 |
-0.46 |
0 |
|
|
235344 |
92309504 |
1 |
O2N3C19H25 |
A2B3C19D25 |
-62.26 |
4.83 |
-9.05 |
-0.63 |
0 |
|
|
235345 |
92309511 |
1 |
ClN5C20H22 |
AB5C20D22 |
104.33 |
7.65 |
-8.5 |
-1.1 |
0 |
|
|
235346 |
92309514 |
1 |
ON5C21H25 |
AB5C21D25 |
75.31 |
9.36 |
-8.15 |
-0.96 |
0 |
|
|
235347 |
92309516 |
1 |
ON5C21H25 |
AB5C21D25 |
77.07 |
6.62 |
-7.96 |
-0.98 |
0 |
|
|
235348 |
92309530 |
1 |
ON5C21H25 |
AB5C21D25 |
74.12 |
7.77 |
-8.34 |
-1.04 |
0 |
|
|
235349 |
92309531 |
1 |
ON5C21H25 |
AB5C21D25 |
73.48 |
7.64 |
-8.38 |
-1.04 |
0 |
|
|
235350 |
92309533 |
1 |
SN5C18H21 |
AB5C18D21 |
121.6 |
7.76 |
-8.28 |
-1.09 |
0 |
|
|
235351 |
92309568 |
1 |
N2O2C21H28 |
A2B2C21D28 |
-91.46 |
6.12 |
-9.07 |
-0.48 |
0 |
|
|
235352 |
92309569 |
1 |
N2O2C21H28 |
A2B2C21D28 |
-96.64 |
4.42 |
-9.36 |
-0.5 |
0 |
|
|
235353 |
92309572 |
1 |
N2O3C22H24 |
A2B3C22D24 |
-91.88 |
3.98 |
-8.48 |
-0.58 |
0 |
|
|
235354 |
92309581 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-166.74 |
4.21 |
-8.61 |
-0.07 |
0 |
|
|
235355 |
92309583 |
1 |
NO4C12H13 |
AB4C12D13 |
-149.5 |
3.91 |
-10.09 |
-0.94 |
0 |
|
|
235356 |
92309585 |
1 |
NO4C12H13 |
AB4C12D13 |
-144.46 |
1.64 |
-9.99 |
-0.77 |
0 |
|
|
235357 |
92309600 |
1 |
ClN2O2C22H25 |
AB2C2D22E25 |
-36.52 |
4.23 |
-8.93 |
-0.23 |
0 |
|
|
235358 |
92309601 |
1 |
ClN2O2C22H25 |
AB2C2D22E25 |
-33.21 |
3.99 |
-8.78 |
-0.36 |
0 |
|
|
235359 |
92309610 |
1 |
ClN2O3C21H25 |
AB2C3D21E25 |
-71.6 |
4.75 |
-8.61 |
-0.29 |
0 |
|
|
235360 |
92309615 |
1 |
ClN2O3C20H23 |
AB2C3D20E23 |
-67.59 |
5.67 |
-8.59 |
-0.16 |
0 |
|
|
235361 |
92309629 |
1 |
N2O5C22H24 |
A2B5C22D24 |
-148.91 |
6.62 |
-8.16 |
-0.72 |
0 |
|
|
235362 |
92309631 |
1 |
BrN2O3H19C20 |
AB2C3D19E20 |
-76.21 |
7.25 |
-8.76 |
-1.26 |
0 |
|
|
235363 |
92309633 |
1 |
ClN2O3H19C20 |
AB2C3D19E20 |
-87.85 |
7.14 |
-8.69 |
-1.24 |
0 |