List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
242476 |
96100302 |
1 |
O3N5C15H23 |
A3B5C15D23 |
-75.09 |
5.57 |
-9.39 |
0.06 |
0 |
|
|
242477 |
96100313 |
1 |
O3N5C14H19 |
A3B5C14D19 |
-40.18 |
1.75 |
-9.3 |
0.0 |
0 |
|
|
242478 |
96100323 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-111.13 |
3.9 |
-9.11 |
0.22 |
0 |
|
|
242479 |
96100325 |
1 |
O3N5C17H19 |
A3B5C17D19 |
-27.6 |
6.98 |
-9.39 |
-0.57 |
0 |
|
|
242480 |
96100334 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
-12.96 |
3.43 |
-8.7 |
-0.26 |
0 |
|
|
242481 |
96100335 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
-16.12 |
3.34 |
-8.56 |
-0.11 |
0 |
|
|
242482 |
96100342 |
1 |
O4N5C15H19 |
A4B5C15D19 |
-84.9 |
2.96 |
-9.28 |
-0.38 |
0 |
|
|
242483 |
96100344 |
2 |
ON2C9H11 |
AB2C9D11 |
-5.44 |
6.42 |
-9.05 |
0.03 |
0 |
|
|
242484 |
96100345 |
2 |
ON2C9H11 |
AB2C9D11 |
-7.07 |
5.6 |
-9.22 |
0.03 |
0 |
|
|
242485 |
96107378 |
3 |
NOC4H5 |
ABC4D5 |
-93.33 |
3.43 |
-9.45 |
-0.66 |
0 |
|
|
242486 |
96107397 |
1 |
FN2O3C13H15 |
AB2C3D13E15 |
-151.68 |
4.9 |
-9.12 |
-0.6 |
0 |
|
|
242487 |
96107406 |
2 |
NO2C7H9 |
AB2C7D9 |
-125.57 |
2.89 |
-8.44 |
-0.3 |
0 |
|
|
242488 |
96107410 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-138.79 |
4.86 |
-8.67 |
-0.5 |
0 |
|
|
242489 |
96107411 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-139.32 |
4.1 |
-8.67 |
-0.53 |
0 |
|
|
242490 |
96107413 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-138.67 |
5.32 |
-8.69 |
-0.51 |
0 |
|
|
242491 |
96107443 |
1 |
FN2O3C13H15 |
AB2C3D13E15 |
-144.89 |
5.05 |
-9.18 |
-0.5 |
0 |
|
|
242492 |
96107456 |
1 |
FON2H15C16 |
ABC2D15E16 |
-24.89 |
2.93 |
-8.93 |
-0.3 |
0 |
|
|
242493 |
96107462 |
1 |
ON3C15H15 |
AB3C15D15 |
29.71 |
3.57 |
-9.06 |
-0.38 |
0 |
|
|
242494 |
96107463 |
1 |
ON3C15H15 |
AB3C15D15 |
28.4 |
3.02 |
-9.02 |
-0.48 |
0 |
|
|
242495 |
96107471 |
1 |
N3O3H15C16 |
A3B3C15D16 |
-51.71 |
5.44 |
-9.74 |
-0.95 |
0 |
|
|
242496 |
96107474 |
1 |
OF2N3H13C15 |
AB2C3D13E15 |
-59.44 |
4.41 |
-9.25 |
-0.66 |
0 |
|
|
242497 |
96107485 |
1 |
ON4C14H14 |
AB4C14D14 |
33.49 |
3.71 |
-8.9 |
-0.61 |
0 |
|
|
242498 |
96107501 |
1 |
FON3H14C15 |
ABC3D14E15 |
-27.88 |
4.52 |
-9.12 |
-0.49 |
0 |
|
|
242499 |
96107523 |
1 |
FON3H14C15 |
ABC3D14E15 |
-28.57 |
5.64 |
-8.95 |
-0.39 |
0 |
|
|
242500 |
96107529 |
1 |
ON4C14H14 |
AB4C14D14 |
35.91 |
2.26 |
-8.6 |
-0.67 |
0 |
|
|
242501 |
96107541 |
1 |
OF2N3H13C15 |
AB2C3D13E15 |
-70.75 |
3.58 |
-9.02 |
-0.66 |
0 |
|
|
242502 |
96107542 |
1 |
FON3H14C15 |
ABC3D14E15 |
-27.16 |
2.87 |
-8.77 |
-0.54 |
0 |
|
|
242503 |
96107544 |
1 |
FON3H14C15 |
ABC3D14E15 |
-29.74 |
3.88 |
-8.97 |
-0.59 |
0 |
|
|
242504 |
96107609 |
1 |
FON4C14H15 |
ABC4D14E15 |
-21.42 |
2.69 |
-9.38 |
-0.69 |
0 |
|
|
242505 |
96107613 |
1 |
ON3C15H21 |
AB3C15D21 |
-10.42 |
4.32 |
-8.79 |
-0.2 |
0 |
|
|
242506 |
96107622 |
1 |
FON3C15H20 |
ABC3D15E20 |
-52.77 |
2.49 |
-8.83 |
-0.4 |
0 |
|
|
242507 |
96107625 |
1 |
FON3C15H20 |
ABC3D15E20 |
-61.99 |
4.04 |
-9.07 |
-0.44 |
0 |
|
|
242508 |
97301712 |
1 |
O2Cl3C4F5 |
A2B3C4D5 |
-346.63 |
1.12 |
-11.79 |
-1.7 |
0 |
|
|
242509 |
97301715 |
1 |
O2C5F5H5 |
A2B5C5D5 |
-335.76 |
1.81 |
-12.07 |
-0.82 |
0 |
|
|
242510 |
97301718 |
1 |
ClH2F3O3C4 |
AB2C3D3E4 |
-275.48 |
2.69 |
-11.63 |
-1.16 |
0 |
|
|
242511 |
97301730 |
1 |
O2C17H18 |
A2B17C18 |
-56.76 |
0.58 |
-8.91 |
-0.48 |
0 |
|
|
242512 |
97301732 |
1 |
ClFO2H10C13 |
ABC2D10E13 |
-90.36 |
0.74 |
-9.38 |
-0.68 |
0 |
|
|
242513 |
97301759 |
1 |
NO2H5F6C9 |
AB2C5D6E9 |
-375.57 |
3.13 |
-9.65 |
-1.42 |
0 |
|
|
242514 |
97301761 |
1 |
NO2H5F6C9 |
AB2C5D6E9 |
-374.84 |
6.2 |
-9.54 |
-1.31 |
0 |
|
|
242515 |
97301762 |
2 |
FO2N3H7C8 |
AB2C3D7E8 |
-73.04 |
1.77 |
-9.88 |
-1.69 |
0 |
|
|
242516 |
97301775 |
1 |
NOC13H17 |
ABC13D17 |
-39.18 |
2.69 |
-8.74 |
0.26 |
0 |
|
|
242518 |
97301791 |
1 |
ClNO4H10C16 |
ABC4D10E16 |
-111.77 |
8.18 |
-10.07 |
-1.69 |
0 |
|
|
242519 |
97301792 |
1 |
FNCl2O2H12C16 |
ABC2D2E12F16 |
-96.14 |
5.8 |
-9.26 |
-0.77 |
0 |
|
|
242520 |
97301801 |
1 |
FNO3C18H18 |
ABC3D18E18 |
-133.54 |
2.32 |
-9.07 |
-0.1 |
0 |
|
|
242521 |
97301810 |
1 |
ClFON3C19H21 |
ABCD3E19F21 |
-45.69 |
1.83 |
-9.04 |
-0.49 |
0 |
|
|
242522 |
97301819 |
1 |
F2N2O3H4C8 |
A2B2C3D4E8 |
-80.39 |
4.5 |
-10.58 |
-1.9 |
0 |
|
|
242523 |
97301824 |
2 |
N2O2F3H6C8 |
A2B2C3D6E8 |
-334.66 |
2.9 |
-10.4 |
-1.44 |
0 |
|
|
242524 |
97301830 |
1 |
N2O5C14H16 |
A2B5C14D16 |
-216.12 |
7.43 |
-9.21 |
-0.71 |
0 |
|
|
242525 |
97301832 |
1 |
SO2C8H18 |
AB2C8D18 |
-121.87 |
3.17 |
-8.3 |
0.51 |
0 |
|
|
242526 |
97301851 |
1 |
ON3C12H25 |
AB3C12D25 |
-56.36 |
2.21 |
-9.24 |
1.23 |
0 |