List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
244395 |
99350597 |
2 |
NO2C11H13 |
AB2C11D13 |
-110.38 |
3.88 |
-7.75 |
-0.13 |
0 |
|
|
244396 |
99350599 |
1 |
O2N3C22H23 |
A2B3C22D23 |
13.31 |
4.93 |
-7.87 |
-0.89 |
0 |
|
|
244397 |
99350600 |
1 |
O2N3C22H23 |
A2B3C22D23 |
11.19 |
3.18 |
-7.9 |
-0.88 |
0 |
|
|
244398 |
99350601 |
1 |
SN4O4C19H26 |
AB4C4D19E26 |
-113.17 |
4.09 |
-8.24 |
-0.32 |
0 |
|
|
244399 |
99350606 |
1 |
N4O4C25H30 |
A4B4C25D30 |
-126.05 |
7.87 |
-8.09 |
-0.44 |
0 |
|
|
244400 |
99350611 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-70.37 |
2.27 |
-8.25 |
-0.85 |
0 |
|
|
244401 |
99350614 |
1 |
S2N3O5C21H27 |
A2B3C5D21E27 |
-147.01 |
2.78 |
-7.87 |
-1.36 |
0 |
|
|
244402 |
99350617 |
1 |
N3O5C25H31 |
A3B5C25D31 |
-157.81 |
0.72 |
-8.4 |
0.2 |
0 |
|
|
244403 |
99350619 |
1 |
Cl2N2O2C21H22 |
A2B2C2D21E22 |
-38.76 |
4.02 |
-7.85 |
-1.07 |
0 |
|
|
244404 |
99350621 |
1 |
SN3O3C24H25 |
AB3C3D24E25 |
-44.81 |
4.56 |
-8.52 |
-0.8 |
0 |
|
|
244405 |
99350622 |
1 |
SN3O3C24H25 |
AB3C3D24E25 |
-46.34 |
4.73 |
-8.12 |
-0.68 |
0 |
|
|
244406 |
99350624 |
1 |
N2O3C24H28 |
A2B3C24D28 |
-75.3 |
1.2 |
-7.79 |
-0.28 |
0 |
|
|
244407 |
99350629 |
1 |
SO3N4C19H20 |
AB3C4D19E20 |
-46.94 |
5.8 |
-7.77 |
-1.71 |
0 |
|
|
244408 |
99350630 |
1 |
SO3N4C19H20 |
AB3C4D19E20 |
-47.06 |
4.1 |
-7.79 |
-1.54 |
0 |
|
|
244409 |
99350632 |
1 |
FN2O3C22H27 |
AB2C3D22E27 |
-129.98 |
1.73 |
-7.7 |
-0.18 |
0 |
|
|
244410 |
99350707 |
1 |
F3O3N4C25H25 |
A3B3C4D25E25 |
-181.78 |
7.41 |
-7.94 |
-1.3 |
0 |
|
|
244411 |
99350729 |
1 |
BrFN2O2C19H20 |
ABC2D2E19F20 |
-76.37 |
3.2 |
-7.87 |
-1.0 |
0 |
|
|
244412 |
99350731 |
1 |
ClN2O3C22H23 |
AB2C3D22E23 |
-67.05 |
2.4 |
-8.35 |
-0.94 |
0 |
|
|
244413 |
99350732 |
1 |
ClN2O3C22H23 |
AB2C3D22E23 |
-66.19 |
2.84 |
-8.66 |
-1.09 |
0 |
|
|
244414 |
99350737 |
2 |
NO2C14H14 |
AB2C14D14 |
-57.24 |
4.62 |
-7.87 |
-0.94 |
0 |
|
|
244415 |
99350745 |
1 |
N3O3C23H29 |
A3B3C23D29 |
-93.73 |
3.45 |
-8.28 |
-0.25 |
0 |
|
|
244416 |
99350763 |
1 |
ClO2N4C23H25 |
AB2C4D23E25 |
1.46 |
6.09 |
-8.17 |
-0.78 |
0 |
|
|
244417 |
99350778 |
1 |
ClSN3O4C21H26 |
ABC3D4E21F26 |
-127.06 |
5.1 |
-7.64 |
-0.4 |
0 |
|
|
244418 |
99350783 |
1 |
N4O4C23H32 |
A4B4C23D32 |
-162.43 |
2.42 |
-7.82 |
0.1 |
0 |
|
|
244419 |
99350787 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-0.25 |
2.89 |
-7.9 |
-0.72 |
0 |
|
|
244420 |
99350791 |
1 |
N3O6C22H23 |
A3B6C22D23 |
-85.69 |
4.61 |
-7.82 |
-1.73 |
0 |
|
|
244421 |
99350796 |
1 |
SN3O3C22H29 |
AB3C3D22E29 |
-87.37 |
1.84 |
-8.28 |
-0.85 |
0 |
|
|
244422 |
99350797 |
1 |
SN3O3C22H29 |
AB3C3D22E29 |
-83.56 |
7.05 |
-8.1 |
-1.1 |
0 |
|
|
244423 |
99350801 |
1 |
N4O4C23H26 |
A4B4C23D26 |
-93.9 |
5.73 |
-8.0 |
-1.27 |
0 |
|
|
244424 |
99350802 |
1 |
N4O4C23H26 |
A4B4C23D26 |
-97.66 |
2.94 |
-8.02 |
-1.25 |
0 |
|
|
244425 |
99350803 |
2 |
NO2C11H14 |
AB2C11D14 |
-124.59 |
6.43 |
-7.73 |
0.06 |
0 |
|
|
244426 |
99350808 |
1 |
SN3O3C19H25 |
AB3C3D19E25 |
-99.55 |
2.48 |
-8.18 |
-0.36 |
0 |
|
|
244427 |
99350809 |
1 |
N2O5C24H28 |
A2B5C24D28 |
-128.27 |
5.35 |
-7.88 |
-0.56 |
0 |
|
|
244428 |
99350810 |
1 |
N2O5C24H28 |
A2B5C24D28 |
-129.41 |
3.7 |
-7.81 |
-0.55 |
0 |
|
|
244429 |
99350811 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-106.53 |
3.63 |
-7.9 |
-0.78 |
0 |
|
|
244430 |
99350812 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-108.46 |
6.04 |
-8.12 |
-0.63 |
0 |
|
|
244431 |
99350817 |
1 |
FN2O3C25H25 |
AB2C3D25E25 |
-73.94 |
3.99 |
-7.87 |
-1.1 |
0 |
|
|
244432 |
99350820 |
1 |
SO2N4C25H30 |
AB2C4D25E30 |
-16.15 |
7.94 |
-8.01 |
-0.53 |
0 |
|
|
244433 |
99350821 |
1 |
N2O2C23H28 |
A2B2C23D28 |
-53.68 |
3.14 |
-7.82 |
0.19 |
0 |
|
|
244434 |
99350822 |
1 |
N2O2C23H28 |
A2B2C23D28 |
-53.22 |
4.01 |
-7.94 |
0.31 |
0 |
|
|
244435 |
99350823 |
1 |
SO2N4C25H30 |
AB2C4D25E30 |
-16.44 |
7.19 |
-7.86 |
-0.4 |
0 |
|
|
244436 |
99350858 |
1 |
SN3O5C24H31 |
AB3C5D24E31 |
-137.16 |
4.33 |
-8.1 |
-0.83 |
0 |
|
|
244437 |
99350867 |
1 |
SN2O4C20H24 |
AB2C4D20E24 |
-116.45 |
2.65 |
-7.86 |
-0.86 |
0 |
|
|
244438 |
99350868 |
1 |
SN2O4C20H24 |
AB2C4D20E24 |
-115.58 |
3.77 |
-7.81 |
-0.89 |
0 |
|
|
244439 |
99350870 |
1 |
O2N5C21H25 |
A2B5C21D25 |
13.62 |
4.09 |
-8.65 |
-0.92 |
0 |
|
|
244440 |
99350871 |
1 |
O3N4C25H30 |
A3B4C25D30 |
-56.46 |
7.45 |
-7.83 |
-0.84 |
0 |
|
|
244441 |
99351102 |
1 |
SN3O5C23H29 |
AB3C5D23E29 |
-148.93 |
5.71 |
-7.98 |
-1.06 |
0 |
|
|
244442 |
99355545 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-21.59 |
6.54 |
-8.44 |
-1.2 |
0 |
|
|
244443 |
99355546 |
1 |
SF2O3N6H16C18 |
AB2C3D6E16F18 |
-82.99 |
7.11 |
-9.66 |
-1.76 |
0 |
|
|
244444 |
99355547 |
1 |
OSN6H18C20 |
ABC6D18E20 |
100.12 |
2.8 |
-8.86 |
-1.79 |
0 |