List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
31323 |
855575 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
-51.58 |
5.02 |
-8.43 |
-0.7 |
0 |
|
|
31324 |
855576 |
1 |
SO2N4C16H20 |
AB2C4D16E20 |
-31.07 |
6.05 |
-9.12 |
-0.8 |
0 |
|
|
31325 |
855577 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-73.7 |
5.97 |
-9.22 |
-0.87 |
0 |
|
|
31326 |
855578 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-60.71 |
4.33 |
-8.63 |
-0.81 |
0 |
|
|
31327 |
855579 |
1 |
SO2N4H16C17 |
AB2C4D16E17 |
3.24 |
6.61 |
-8.87 |
-0.8 |
0 |
|
|
31328 |
855580 |
1 |
ClN3C10H10 |
AB3C10D10 |
60.09 |
1.8 |
-8.35 |
-0.39 |
0 |
|
|
31329 |
855582 |
1 |
SO2N5C16H19 |
AB2C5D16E19 |
21.94 |
5.69 |
-8.76 |
-0.56 |
0 |
|
|
31330 |
855583 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-63.01 |
2.64 |
-9.04 |
-0.8 |
0 |
|
|
31331 |
855584 |
1 |
O2N3C21H21 |
A2B3C21D21 |
-27.14 |
2.46 |
-9.09 |
-0.86 |
0 |
|
|
31332 |
855586 |
1 |
OSN3C17H19 |
ABC3D17E19 |
-16.55 |
4.01 |
-8.12 |
-1.21 |
0 |
|
|
31333 |
855587 |
1 |
ON5C19H27 |
AB5C19D27 |
29.33 |
6.66 |
-9.02 |
-0.19 |
0 |
|
|
31334 |
855588 |
1 |
ON5C19H27 |
AB5C19D27 |
28.91 |
6.47 |
-8.93 |
-0.18 |
0 |
|
|
31335 |
855589 |
1 |
FSN2O2H15C18 |
ABC2D2E15F18 |
-34.83 |
3.51 |
-8.94 |
-1.02 |
0 |
|
|
31336 |
855591 |
1 |
FN6C18H27 |
AB6C18D27 |
38.15 |
5.37 |
-8.45 |
-0.46 |
0 |
|
|
31337 |
855593 |
1 |
OSN3C19H21 |
ABC3D19E21 |
3.69 |
6.06 |
-9.02 |
-1.35 |
0 |
|
|
31338 |
855594 |
1 |
OSN3H17C20 |
ABC3D17E20 |
50.8 |
7.48 |
-8.88 |
-1.51 |
0 |
|
|
31339 |
855595 |
1 |
NSO2C14H15 |
ABC2D14E15 |
-62.43 |
6.61 |
-9.01 |
-1.1 |
0 |
|
|
31340 |
855596 |
1 |
N6C19H28 |
A6B19C28 |
88.79 |
7.1 |
-8.36 |
-0.23 |
0 |
|
|
31341 |
855597 |
1 |
N6C19H28 |
A6B19C28 |
89.12 |
7.75 |
-8.68 |
-0.03 |
0 |
|
|
31342 |
855598 |
1 |
ON6C17H26 |
AB6C17D26 |
54.54 |
9.55 |
-8.87 |
0.02 |
0 |
|
|
31343 |
855599 |
1 |
ON6C17H26 |
AB6C17D26 |
52.52 |
10.05 |
-8.71 |
-0.24 |
0 |
|
|
31344 |
855601 |
1 |
SN2O2H18C19 |
AB2C2D18E19 |
2.38 |
2.46 |
-8.68 |
-0.71 |
0 |
|
|
31345 |
855602 |
1 |
ClOSN2H15C17 |
ABCD2E15F17 |
37.12 |
1.98 |
-8.96 |
-1.08 |
0 |
|
|
31346 |
855603 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-74.59 |
3.32 |
-8.58 |
-0.75 |
0 |
|
|
31347 |
855604 |
1 |
SN2O2C18H24 |
AB2C2D18E24 |
-64.75 |
4.86 |
-8.6 |
-0.86 |
0 |
|
|
31348 |
855606 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-54.87 |
5.24 |
-8.68 |
-0.9 |
0 |
|
|
31349 |
855607 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-90.7 |
4.63 |
-8.71 |
-0.98 |
0 |
|
|
31350 |
855608 |
1 |
OSN2C19H24 |
ABC2D19E24 |
-30.46 |
5.19 |
-8.79 |
-0.86 |
0 |
|
|
31351 |
855610 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-64.56 |
5.08 |
-8.27 |
-0.72 |
0 |
|
|
31352 |
855611 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-53.96 |
6.84 |
-8.47 |
-0.87 |
0 |
|
|
31353 |
855612 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
-18.49 |
6.26 |
-9.29 |
-1.4 |
0 |
|
|
31354 |
855613 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-58.95 |
4.56 |
-8.38 |
-0.78 |
0 |
|
|
31355 |
855614 |
1 |
N6C15H16 |
A6B15C16 |
113.13 |
2.35 |
-8.77 |
-0.72 |
0 |
|
|
31356 |
855615 |
1 |
SO4N5C13H15 |
AB4C5D13E15 |
-57.34 |
6.77 |
-10.4 |
-2.15 |
0 |
|
|
31357 |
855616 |
1 |
SO4N5C13H15 |
AB4C5D13E15 |
-55.79 |
4.14 |
-9.98 |
-1.91 |
0 |
|
|
31358 |
855618 |
1 |
SO2N5C16H17 |
AB2C5D16E17 |
18.79 |
5.1 |
-8.96 |
-0.51 |
0 |
|
|
31359 |
855619 |
1 |
N2O2H18C21 |
A2B2C18D21 |
-18.21 |
4.88 |
-9.2 |
-1.11 |
0 |
|
|
31360 |
855620 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-89.33 |
2.59 |
-8.94 |
-0.75 |
0 |
|
|
31361 |
855621 |
1 |
N2O3C20H22 |
A2B3C20D22 |
-85.71 |
5.51 |
-9.0 |
-1.0 |
0 |
|
|
31362 |
855622 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-27.78 |
5.06 |
-8.97 |
-0.43 |
0 |
|
|
31363 |
855623 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
-17.39 |
5.41 |
-9.03 |
-0.51 |
0 |
|
|
31364 |
855624 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-42.1 |
5.98 |
-8.94 |
-0.45 |
0 |
|
|
31365 |
855625 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
-16.86 |
6.11 |
-9.16 |
-0.61 |
0 |
|
|
31366 |
855626 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-40.05 |
4.2 |
-9.08 |
-0.56 |
0 |
|
|
31367 |
855627 |
1 |
ClON3H14C17 |
ABC3D14E17 |
32.92 |
2.73 |
-8.96 |
-0.67 |
0 |
|
|
31368 |
855628 |
1 |
ClSO2N3C15H16 |
ABC2D3E15F16 |
-20.03 |
2.88 |
-9.12 |
-1.12 |
0 |
|
|
31369 |
855629 |
1 |
SO2N5C15H15 |
AB2C5D15E15 |
49.17 |
6.15 |
-9.19 |
-0.81 |
0 |
|
|
31370 |
855630 |
1 |
SO2N5C16H17 |
AB2C5D16E17 |
40.13 |
7.28 |
-8.98 |
-0.5 |
0 |
|
|
31371 |
855631 |
1 |
SN2O3H16C18 |
AB2C3D16E18 |
-51.17 |
5.48 |
-8.85 |
-0.66 |
0 |
|
|
31372 |
855632 |
1 |
OSN3C18H19 |
ABC3D18E19 |
13.61 |
1.59 |
-9.04 |
-0.84 |
0 |
|
|
31373 |
855633 |
1 |
ON5C15H19 |
AB5C15D19 |
43.99 |
7.58 |
-10.18 |
-1.37 |
0 |
|
|
31374 |
855634 |
1 |
OSN5C15H19 |
ABC5D15E19 |
21.3 |
5.23 |
-8.49 |
-0.28 |
0 |
|
|
31375 |
855635 |
1 |
ClOSN4C12H13 |
ABCD4E12F13 |
16.97 |
3.34 |
-9.31 |
-0.83 |
0 |
|
|
31376 |
855636 |
1 |
SO2N4C12H14 |
AB2C4D12E14 |
-9.76 |
5.01 |
-8.65 |
-0.64 |
0 |
|
|
31377 |
855637 |
1 |
ON2S3H10C13 |
AB2C3D10E13 |
53.66 |
4.28 |
-8.61 |
-1.07 |
0 |
|
|
31378 |
855638 |
1 |
N2O5C17H22 |
A2B5C17D22 |
-190.17 |
5.87 |
-8.65 |
-0.92 |
0 |
|
|
31379 |
855639 |
1 |
N2F3O3C16H17 |
A2B3C3D16E17 |
-270.76 |
7.2 |
-9.04 |
-1.17 |
0 |
|
|
31380 |
855640 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-124.52 |
7.63 |
-9.14 |
-1.19 |
0 |
|
|
31381 |
855641 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-117.13 |
4.63 |
-8.86 |
-0.69 |
0 |
|
|
31382 |
855642 |
1 |
N2O3C17H22 |
A2B3C17D22 |
-126.67 |
6.94 |
-9.12 |
-1.12 |
0 |
|
|
31383 |
855643 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-93.01 |
3.55 |
-8.99 |
-0.68 |
0 |
|
|
31384 |
855645 |
2 |
ON2H7C9 |
AB2C7D9 |
91.97 |
3.64 |
-8.23 |
-1.47 |
0 |
|
|
31385 |
855646 |
1 |
ON6C18H26 |
AB6C18D26 |
50.21 |
5.67 |
-8.79 |
-0.24 |
0 |
|
|
31386 |
855647 |
1 |
ON6C18H26 |
AB6C18D26 |
50.24 |
6.15 |
-8.82 |
-0.17 |
0 |
|
|
31387 |
855648 |
1 |
SN2O2H14C15 |
AB2C2D14E15 |
-41.68 |
4.79 |
-8.14 |
-1.29 |
0 |
|
|
31388 |
855649 |
1 |
SN2O2C16H16 |
AB2C2D16E16 |
-50.67 |
4.88 |
-8.1 |
-1.32 |
0 |
|
|
31389 |
855650 |
2 |
ON3C8H10 |
AB3C8D10 |
0.25 |
7.08 |
-9.25 |
-0.66 |
0 |
|
|
31390 |
855654 |
2 |
NOC11H12 |
ABC11D12 |
-59.15 |
3.38 |
-8.89 |
-0.87 |
0 |
|
|
31391 |
855656 |
2 |
NOC11H12 |
ABC11D12 |
-56.83 |
6.04 |
-9.14 |
-0.98 |
0 |
|
|
31392 |
855657 |
1 |
N2O2C21H22 |
A2B2C21D22 |
-52.22 |
7.67 |
-9.06 |
-1.04 |
0 |
|
|
31393 |
855658 |
2 |
NOC11H12 |
ABC11D12 |
-59.43 |
3.58 |
-8.66 |
-0.43 |
0 |
|
|
31394 |
855659 |
1 |
N2O2C21H22 |
A2B2C21D22 |
-53.27 |
3.23 |
-8.93 |
-0.79 |
0 |
|
|
31395 |
855661 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-82.42 |
3.1 |
-8.99 |
-0.85 |
0 |
|
|
31396 |
855664 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-88.27 |
4.28 |
-8.95 |
-0.77 |
0 |
|
|
31397 |
855665 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-65.85 |
3.07 |
-8.4 |
-0.59 |
0 |
|
|
31398 |
855667 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-68.2 |
5.68 |
-8.64 |
-0.84 |
0 |
|
|
31399 |
855670 |
1 |
FOSN5H14C16 |
ABCD5E14F16 |
41.78 |
2.87 |
-9.58 |
-1.37 |
0 |
|
|
31400 |
855671 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-68.45 |
5.82 |
-8.69 |
-0.78 |
0 |
|
|
31401 |
855672 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-56.38 |
2.46 |
-8.54 |
-0.66 |
0 |
|
|
31402 |
855675 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-118.72 |
4.01 |
-8.93 |
-0.98 |
0 |
|
|
31403 |
855676 |
1 |
O2S2N3C16H19 |
A2B2C3D16E19 |
-53.61 |
7.33 |
-8.95 |
-1.51 |
0 |
|
|
31404 |
855677 |
1 |
N2O3C18H18 |
A2B3C18D18 |
-79.09 |
5.54 |
-9.04 |
-0.86 |
0 |
|
|
31405 |
855678 |
1 |
SN3O3H15C17 |
AB3C3D15E17 |
-31.15 |
6.96 |
-9.26 |
-1.25 |
0 |
|
|
31406 |
855679 |
1 |
SN3O3C15H17 |
AB3C3D15E17 |
-64.74 |
6.17 |
-9.14 |
-1.06 |
0 |
|
|
31407 |
855682 |
1 |
SO3N4C14H14 |
AB3C4D14E14 |
-47.09 |
4.14 |
-8.99 |
-1.06 |
0 |
|
|
31408 |
855683 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-61.3 |
6.52 |
-8.27 |
-0.9 |
0 |
|
|
31409 |
855684 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
-30.04 |
1.4 |
-8.5 |
-1.24 |
0 |
|
|
31410 |
855685 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-118.77 |
6.15 |
-8.13 |
-1.0 |
0 |
|
|
31411 |
855686 |
1 |
OSN3C18H19 |
ABC3D18E19 |
17.72 |
2.51 |
-8.98 |
-1.15 |
0 |
|
|
31412 |
855687 |
1 |
O3N6C16H18 |
A3B6C16D18 |
28.54 |
3.36 |
-9.29 |
-0.57 |
0 |
|
|
31413 |
855688 |
1 |
OSN3C19H21 |
ABC3D19E21 |
16.0 |
8.35 |
-8.87 |
-1.38 |
0 |
|
|
31414 |
855689 |
2 |
ON3C8H12 |
AB3C8D12 |
19.23 |
7.43 |
-8.83 |
-0.13 |
0 |
|
|
31415 |
855690 |
2 |
ON3C8H12 |
AB3C8D12 |
19.68 |
4.85 |
-8.66 |
-0.15 |
0 |
|
|
31416 |
855692 |
2 |
N3C9H17 |
A3B9C17 |
28.9 |
7.21 |
-8.5 |
-0.02 |
0 |
|
|
31417 |
855693 |
1 |
OSN3C18H19 |
ABC3D18E19 |
11.19 |
6.43 |
-9.14 |
-1.4 |
0 |
|
|
31418 |
855694 |
1 |
ON6C16H24 |
AB6C16D24 |
50.96 |
6.92 |
-8.7 |
-0.03 |
0 |
|
|
31419 |
855696 |
1 |
OSN3C18H19 |
ABC3D18E19 |
20.5 |
9.07 |
-8.84 |
-1.36 |
0 |
|
|
31420 |
855698 |
1 |
OSN6C16H24 |
ABC6D16E24 |
39.34 |
2.44 |
-8.94 |
-0.78 |
0 |
|
|
31421 |
855699 |
1 |
FO2N3H14C19 |
AB2C3D14E19 |
32.71 |
4.82 |
-8.24 |
-1.5 |
0 |
|
|
31422 |
855700 |
1 |
O2N3H15C19 |
A2B3C15D19 |
80.59 |
4.88 |
-8.06 |
-1.39 |
0 |