List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
344434 |
127267610 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-93.93 |
2.43 |
-9.45 |
-0.28 |
0 |
|
|
344435 |
127267611 |
1 |
O2N7C19H25 |
A2B7C19D25 |
36.04 |
4.11 |
-9.36 |
-0.78 |
0 |
|
|
344436 |
127267612 |
1 |
O3N5C18H29 |
A3B5C18D29 |
-95.56 |
2.91 |
-9.34 |
-0.48 |
0 |
|
|
344437 |
127267613 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-84.25 |
2.84 |
-8.71 |
-0.46 |
0 |
|
|
344438 |
127267614 |
1 |
O2N6C17H26 |
A2B6C17D26 |
-4.59 |
5.9 |
-8.99 |
-0.28 |
0 |
|
|
344439 |
127267615 |
2 |
ON3C8H11 |
AB3C8D11 |
36.15 |
4.49 |
-9.21 |
-0.4 |
0 |
|
|
344440 |
127267616 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-31.53 |
3.78 |
-8.6 |
-0.52 |
0 |
|
|
344441 |
127267617 |
1 |
SO2N5C15H19 |
AB2C5D15E19 |
35.86 |
3.24 |
-9.33 |
-0.82 |
0 |
|
|
344442 |
127267618 |
1 |
ClO2N4C18H21 |
AB2C4D18E21 |
8.68 |
2.69 |
-9.46 |
-0.51 |
0 |
|
|
344443 |
127267619 |
1 |
O3N4C17H20 |
A3B4C17D20 |
-31.4 |
3.59 |
-9.44 |
-0.52 |
0 |
|
|
344444 |
127267620 |
1 |
O2N5C16H21 |
A2B5C16D21 |
3.03 |
3.81 |
-9.31 |
-0.43 |
0 |
|
|
344445 |
127267621 |
1 |
SO2N5C20H23 |
AB2C5D20E23 |
26.74 |
4.83 |
-9.12 |
-0.94 |
0 |
|
|
344446 |
127267622 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-32.03 |
5.02 |
-8.54 |
-0.41 |
0 |
|
|
344447 |
127267623 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-50.5 |
5.9 |
-8.92 |
-0.31 |
0 |
|
|
344448 |
127267624 |
1 |
O2N5C18H19 |
A2B5C18D19 |
34.22 |
4.41 |
-9.47 |
-1.01 |
0 |
|
|
344449 |
127267625 |
1 |
ClO2N6C16H21 |
AB2C6D16E21 |
4.93 |
3.72 |
-9.56 |
-0.98 |
0 |
|
|
344450 |
127267626 |
2 |
N2O2C8H13 |
A2B2C8D13 |
-119.43 |
5.19 |
-9.32 |
-0.41 |
0 |
|
|
344451 |
127267627 |
1 |
N4O4C17H28 |
A4B4C17D28 |
-125.69 |
3.83 |
-9.34 |
-0.5 |
0 |
|
|
344452 |
127267628 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-66.7 |
4.39 |
-9.51 |
-0.57 |
0 |
|
|
344453 |
127267629 |
2 |
ON3C9H12 |
AB3C9D12 |
8.39 |
3.3 |
-8.82 |
-0.49 |
0 |
|
|
344454 |
127267630 |
1 |
SO2N4C16H20 |
AB2C4D16E20 |
24.21 |
4.59 |
-9.07 |
-0.59 |
0 |
|
|
344455 |
127267631 |
1 |
O3N6C19H24 |
A3B6C19D24 |
8.06 |
3.79 |
-9.48 |
-1.16 |
0 |
|
|
344456 |
127267632 |
1 |
BrO2N6C15H19 |
AB2C6D15E19 |
20.21 |
4.3 |
-9.21 |
-1.17 |
0 |
|
|
344457 |
127267633 |
2 |
FON3C8H11 |
ABC3D8E11 |
-100.1 |
2.8 |
-9.19 |
-0.37 |
0 |
|
|
344458 |
127267634 |
1 |
ClO3N5C15H20 |
AB3C5D15E20 |
-19.6 |
2.4 |
-9.29 |
-0.38 |
0 |
|
|
344459 |
127267635 |
2 |
ON2C9H11 |
AB2C9D11 |
-3.86 |
4.27 |
-9.22 |
-0.46 |
0 |
|
|
344460 |
127267636 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-45.19 |
2.81 |
-9.34 |
-0.23 |
0 |
|
|
344461 |
127267637 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-61.7 |
3.0 |
-9.36 |
-0.54 |
0 |
|
|
344462 |
127267638 |
1 |
O2N5C16H27 |
A2B5C16D27 |
-31.47 |
4.43 |
-8.88 |
-0.26 |
0 |
|
|
344463 |
127267639 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-4.86 |
4.26 |
-8.61 |
-0.48 |
0 |
|
|
344464 |
127267640 |
1 |
O2N5C21H29 |
A2B5C21D29 |
1.29 |
3.05 |
-8.68 |
-0.44 |
0 |
|
|
344465 |
127267641 |
1 |
O2N5C20H27 |
A2B5C20D27 |
0.27 |
4.78 |
-9.11 |
-0.37 |
0 |
|
|
344466 |
127267642 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-62.07 |
2.32 |
-9.3 |
-0.49 |
0 |
|
|
344467 |
127267643 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-58.68 |
4.57 |
-8.71 |
-0.44 |
0 |
|
|
344468 |
127267644 |
1 |
FO3N4C20H25 |
AB3C4D20E25 |
-93.03 |
2.7 |
-9.49 |
-0.53 |
0 |
|
|
344469 |
127267645 |
1 |
FO3N4C20H25 |
AB3C4D20E25 |
-92.75 |
2.88 |
-9.49 |
-0.55 |
0 |
|
|
344470 |
127267646 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-45.62 |
3.05 |
-9.12 |
-0.49 |
0 |
|
|
344471 |
127267647 |
1 |
SO3N5C15H21 |
AB3C5D15E21 |
-64.28 |
3.33 |
-8.9 |
-0.53 |
0 |
|
|
344472 |
127267648 |
1 |
SO2N5C14H19 |
AB2C5D14E19 |
6.77 |
1.78 |
-9.45 |
-0.49 |
0 |
|
|
344473 |
127267649 |
1 |
O2N6C17H20 |
A2B6C17D20 |
36.94 |
4.98 |
-8.67 |
-0.47 |
0 |
|
|
344474 |
127267650 |
1 |
O2N4C19H24 |
A2B4C19D24 |
9.85 |
3.85 |
-9.05 |
-0.32 |
0 |
|
|
344475 |
127268059 |
1 |
SO2N5C19H27 |
AB2C5D19E27 |
1.2 |
5.06 |
-8.83 |
-0.6 |
0 |
|
|
344476 |
127268060 |
1 |
O3N5C20H31 |
A3B5C20D31 |
-90.01 |
7.87 |
-9.23 |
-0.59 |
0 |
|
|
344477 |
127268061 |
1 |
FO3N4C20H25 |
AB3C4D20E25 |
-97.36 |
3.4 |
-9.33 |
-0.62 |
0 |
|
|
344478 |
127268062 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-52.53 |
2.83 |
-8.58 |
-0.44 |
0 |
|
|
344479 |
127268063 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-60.22 |
5.29 |
-9.24 |
-1.18 |
0 |
|
|
344480 |
127268064 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-49.5 |
4.57 |
-9.05 |
-1.04 |
0 |
|
|
344481 |
127268065 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-60.26 |
5.32 |
-9.17 |
-1.14 |
0 |
|
|
344482 |
127268066 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-52.13 |
4.16 |
-9.16 |
-1.08 |
0 |
|
|
344483 |
127268067 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-94.34 |
2.48 |
-9.2 |
-0.41 |
0 |