List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
363589 |
127311668 |
1 |
BrO2N3C16H22 |
AB2C3D16E22 |
-64.91 |
5.34 |
-8.39 |
-0.17 |
0 |
|
|
363590 |
127311669 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-128.3 |
6.31 |
-8.66 |
0.28 |
0 |
|
|
363591 |
127311670 |
1 |
S2N3O3C11H21 |
A2B3C3D11E21 |
-141.2 |
5.96 |
-8.77 |
0.5 |
0 |
|
|
363592 |
127311671 |
1 |
SO2N3C12H23 |
AB2C3D12E23 |
-102.57 |
2.47 |
-8.58 |
0.68 |
0 |
|
|
363593 |
127311672 |
1 |
BrON2C10H11 |
ABC2D10E11 |
-16.62 |
6.21 |
-8.8 |
-0.11 |
0 |
|
|
363594 |
127311673 |
1 |
OSN4C16H32 |
ABC4D16E32 |
-90.16 |
1.19 |
-8.62 |
0.64 |
0 |
|
|
363595 |
127311674 |
1 |
N3O3C19H35 |
A3B3C19D35 |
-160.03 |
2.97 |
-8.83 |
1.21 |
0 |
|
|
363596 |
127311675 |
1 |
SO2N4C14H26 |
AB2C4D14E26 |
-110.74 |
3.7 |
-8.74 |
0.53 |
0 |
|
|
363597 |
127311676 |
1 |
O2N4C13H24 |
A2B4C13D24 |
-76.53 |
3.83 |
-8.84 |
0.9 |
0 |
|
|
363598 |
127311677 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-85.52 |
5.32 |
-9.03 |
-0.32 |
0 |
|
|
363599 |
127311678 |
1 |
S2O3N4C14H28 |
A2B3C4D14E28 |
-150.88 |
5.75 |
-8.66 |
0.43 |
0 |
|
|
363600 |
127311679 |
2 |
ON2C8H14 |
AB2C8D14 |
-64.99 |
5.41 |
-8.93 |
0.88 |
0 |
|
|
363601 |
127311680 |
1 |
SO2N4C16H28 |
AB2C4D16E28 |
-86.22 |
4.08 |
-8.74 |
0.54 |
0 |
|
|
363602 |
127311681 |
1 |
SO2N4C16H30 |
AB2C4D16E30 |
-117.7 |
4.2 |
-8.73 |
0.55 |
0 |
|
|
363603 |
127311682 |
1 |
O2N3C18H29 |
A2B3C18D29 |
-73.24 |
3.57 |
-8.65 |
0.8 |
0 |
|
|
363604 |
127311683 |
1 |
SO2N3C13H25 |
AB2C3D13E25 |
-107.71 |
3.53 |
-8.59 |
0.68 |
0 |
|
|
363605 |
127311684 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-10.88 |
5.8 |
-8.9 |
-0.62 |
0 |
|
|
363606 |
127311685 |
1 |
O2N5C15H25 |
A2B5C15D25 |
-60.5 |
3.94 |
-9.38 |
0.27 |
0 |
|
|
363607 |
127311686 |
2 |
ON3C9H15 |
AB3C9D15 |
-55.21 |
4.2 |
-8.68 |
-0.23 |
0 |
|
|
363608 |
127311687 |
1 |
O2N3C12H23 |
A2B3C12D23 |
-81.18 |
2.38 |
-8.88 |
1.04 |
0 |
|
|
363609 |
127311688 |
1 |
SO2N3C12H23 |
AB2C3D12E23 |
-102.97 |
2.68 |
-8.71 |
0.56 |
0 |
|
|
363610 |
127311689 |
1 |
N3O3C12H23 |
A3B3C12D23 |
-112.1 |
3.7 |
-8.94 |
0.98 |
0 |
|
|
363611 |
127311690 |
1 |
SN3O3C12H23 |
AB3C3D12E23 |
-135.19 |
2.14 |
-8.66 |
0.61 |
0 |
|
|
363612 |
127311691 |
1 |
SO2N3C13H25 |
AB2C3D13E25 |
-107.11 |
3.73 |
-8.65 |
0.62 |
0 |
|
|
363613 |
127311692 |
1 |
SO3N4C13H26 |
AB3C4D13E26 |
-126.63 |
4.01 |
-8.84 |
0.23 |
0 |
|
|
363614 |
127311693 |
1 |
S2O3N4C13H26 |
A2B3C4D13E26 |
-146.03 |
2.95 |
-8.49 |
0.45 |
0 |
|
|
363615 |
127311694 |
1 |
O2N3C13H25 |
A2B3C13D25 |
-85.84 |
2.91 |
-8.89 |
1.21 |
0 |
|
|
363616 |
127311695 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-93.61 |
4.89 |
-8.64 |
-0.32 |
0 |
|
|
363617 |
127311696 |
1 |
SO2N3C13H25 |
AB2C3D13E25 |
-106.8 |
2.62 |
-8.65 |
0.62 |
0 |
|
|
363618 |
127311697 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-43.13 |
4.56 |
-8.66 |
-0.33 |
0 |
|
|
363619 |
127311720 |
1 |
OSN5C14H29 |
ABC5D14E29 |
-49.92 |
3.28 |
-8.46 |
0.64 |
0 |
|
|
363620 |
127311721 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-126.71 |
3.93 |
-8.92 |
0.35 |
0 |
|
|
363621 |
127311722 |
1 |
SO4N5C15H29 |
AB4C5D15E29 |
-141.92 |
3.92 |
-8.93 |
-0.34 |
0 |
|
|
363622 |
127311723 |
1 |
SO3N5C18H25 |
AB3C5D18E25 |
-38.85 |
4.34 |
-8.82 |
-1.33 |
0 |
|
|
363623 |
127311724 |
1 |
ON4C20H28 |
AB4C20D28 |
3.15 |
2.88 |
-8.52 |
0.02 |
0 |
|
|
363624 |
127311725 |
2 |
ON2C9H16 |
AB2C9D16 |
-87.29 |
0.54 |
-8.97 |
0.83 |
0 |
|
|
363625 |
127311726 |
1 |
ClO2N4C18H25 |
AB2C4D18E25 |
-48.6 |
5.78 |
-9.06 |
-0.64 |
0 |
|
|
363626 |
127311727 |
1 |
O3N5C17H31 |
A3B5C17D31 |
-106.86 |
4.41 |
-8.87 |
0.61 |
0 |
|
|
363627 |
127311728 |
1 |
ON4C21H30 |
AB4C21D30 |
-9.78 |
4.17 |
-8.23 |
0.22 |
0 |
|
|
363628 |
127311729 |
1 |
O2N4C17H30 |
A2B4C17D30 |
-85.7 |
5.84 |
-8.85 |
0.97 |
0 |
|
|
363629 |
127311730 |
2 |
ON2C10H15 |
AB2C10D15 |
-56.13 |
2.72 |
-9.06 |
-0.09 |
0 |
|
|
363630 |
127311731 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-90.24 |
3.6 |
-8.98 |
-0.48 |
0 |
|
|
363631 |
127311732 |
1 |
O3N4C16H28 |
A3B4C16D28 |
-112.01 |
1.69 |
-8.92 |
0.71 |
0 |
|
|
363632 |
127311733 |
2 |
ON2C10H15 |
AB2C10D15 |
-58.16 |
6.06 |
-9.07 |
0.29 |
0 |
|
|
363633 |
127311734 |
1 |
O2N4C17H30 |
A2B4C17D30 |
-86.77 |
3.28 |
-8.95 |
0.98 |
0 |
|
|
363634 |
127311735 |
2 |
ON3C8H14 |
AB3C8D14 |
-11.71 |
4.4 |
-9.01 |
-0.25 |
0 |
|
|
363635 |
127311736 |
1 |
ON6C12H20 |
AB6C12D20 |
34.85 |
9.14 |
-9.14 |
0.22 |
0 |
|
|
363636 |
127311737 |
1 |
OCl2N5C16H23 |
AB2C5D16E23 |
1.5 |
3.13 |
-8.88 |
-0.83 |
0 |
|
|
363637 |
127311738 |
1 |
O2N5C18H33 |
A2B5C18D33 |
-81.19 |
0.89 |
-8.9 |
0.84 |
0 |
|
|
363638 |
127311739 |
1 |
O2N5C19H35 |
A2B5C19D35 |
-101.87 |
3.96 |
-8.91 |
1.02 |
0 |