List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
430581 |
135170647 |
1 |
NSC9H13 |
ABC9D13 |
33.06 |
2.95 |
-8.99 |
-0.2 |
0 |
|
|
430582 |
135170648 |
1 |
NSC9H13 |
ABC9D13 |
12.16 |
3.36 |
-9.02 |
-0.14 |
0 |
|
|
430583 |
135170649 |
1 |
FNSC6H10 |
ABCD6E10 |
-47.49 |
5.81 |
-8.55 |
-0.13 |
0 |
|
|
430584 |
135170650 |
1 |
FNOC8H12 |
ABCD8E12 |
-53.69 |
1.83 |
-9.96 |
0.02 |
0 |
|
|
430585 |
135170651 |
1 |
BrNOC8H12 |
ABCD8E12 |
-9.31 |
2.16 |
-9.7 |
-0.21 |
0 |
|
|
430586 |
135170652 |
1 |
ON2C9H12 |
AB2C9D12 |
17.84 |
1.5 |
-10.42 |
-0.53 |
0 |
|
|
430587 |
135170653 |
1 |
ON2C8H10 |
AB2C8D10 |
24.54 |
1.78 |
-10.47 |
-0.57 |
0 |
|
|
430588 |
135170654 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-82.83 |
5.12 |
-9.05 |
-0.16 |
0 |
|
|
430589 |
135170655 |
1 |
FN2C8H11 |
AB2C8D11 |
-24.57 |
5.49 |
-9.92 |
-0.58 |
0 |
|
|
430590 |
135170656 |
1 |
NO3C10H13 |
AB3C10D13 |
-97.4 |
5.03 |
-9.73 |
-0.52 |
0 |
|
|
430591 |
135170657 |
1 |
NO3C11H17 |
AB3C11D17 |
-136.02 |
5.29 |
-9.67 |
-0.47 |
0 |
|
|
430592 |
135170658 |
1 |
BrNO4C7H8 |
ABC4D7E8 |
-135.22 |
3.25 |
-10.18 |
-1.33 |
0 |
|
|
430593 |
135170659 |
1 |
NO4C10H15 |
AB4C10D15 |
-161.45 |
4.51 |
-9.88 |
-0.89 |
0 |
|
|
430594 |
135170660 |
1 |
NO3C10H15 |
AB3C10D15 |
-129.9 |
3.18 |
-9.79 |
-0.55 |
0 |
|
|
430595 |
135170661 |
1 |
NO2C6H9 |
AB2C6D9 |
-76.0 |
2.14 |
-9.83 |
-0.42 |
0 |
|
|
430596 |
135170662 |
1 |
NO4C16H21 |
AB4C16D21 |
-158.08 |
3.65 |
-9.09 |
-0.55 |
0 |
|
|
430597 |
135170663 |
1 |
NO2C8H13 |
AB2C8D13 |
-85.87 |
2.26 |
-9.81 |
-0.4 |
0 |
|
|
430598 |
135170664 |
1 |
ClNO3C7H8 |
ABC3D7E8 |
-114.05 |
3.78 |
-10.12 |
-0.97 |
0 |
|
|
430599 |
135170665 |
1 |
NO4C11H17 |
AB4C11D17 |
-168.81 |
3.03 |
-9.95 |
-0.79 |
0 |
|
|
430600 |
135170666 |
1 |
NO4C11H17 |
AB4C11D17 |
-167.73 |
2.74 |
-9.93 |
-0.86 |
0 |
|
|
430601 |
135170667 |
1 |
NO3C13H21 |
AB3C13D21 |
-142.51 |
2.92 |
-9.72 |
-0.4 |
0 |
|
|
430602 |
135170668 |
1 |
NO3C12H19 |
AB3C12D19 |
-140.11 |
5.3 |
-9.66 |
-0.48 |
0 |
|
|
430603 |
135170669 |
1 |
SN2C8H12 |
AB2C8D12 |
46.44 |
3.5 |
-10.08 |
-0.74 |
0 |
|
|
430604 |
135170670 |
1 |
ClSN2C6H7 |
ABC2D6E7 |
53.18 |
2.42 |
-10.25 |
-1.04 |
0 |
|
|
430605 |
135170671 |
1 |
OSN2C7H12 |
ABC2D7E12 |
-16.48 |
3.89 |
-9.88 |
-0.54 |
0 |
|
|
430606 |
135170672 |
1 |
NO4C10H15 |
AB4C10D15 |
-163.35 |
3.15 |
-9.95 |
-0.83 |
0 |
|
|
430607 |
135170673 |
1 |
FSN2C6H7 |
ABC2D6E7 |
11.41 |
2.59 |
-10.34 |
-1.03 |
0 |
|
|
430608 |
135170674 |
1 |
NO3C11H15 |
AB3C11D15 |
-100.55 |
3.49 |
-9.78 |
-0.53 |
0 |
|
|
430609 |
135170675 |
1 |
NO3C11H17 |
AB3C11D17 |
-134.44 |
5.21 |
-9.68 |
-0.49 |
0 |
|
|
430610 |
135170676 |
1 |
NO3C14H15 |
AB3C14D15 |
-90.84 |
4.45 |
-9.55 |
-1.05 |
0 |
|
|
430611 |
135170677 |
1 |
NSO2C7H11 |
ABC2D7E11 |
-74.95 |
0.34 |
-8.77 |
-0.63 |
0 |
|
|
430612 |
135170678 |
1 |
NSO3C9H13 |
ABC3D9E13 |
-116.69 |
5.67 |
-9.09 |
-0.9 |
0 |
|
|
430613 |
135170679 |
1 |
NO3C10H15 |
AB3C10D15 |
-130.33 |
5.25 |
-9.69 |
-0.48 |
0 |
|
|
430614 |
135170680 |
1 |
NO2C11H11 |
AB2C11D11 |
-42.69 |
1.99 |
-9.44 |
-0.93 |
0 |
|
|
430615 |
135170681 |
1 |
ClNO3C4H4 |
ABC3D4E4 |
-76.32 |
1.73 |
-10.4 |
-1.29 |
0 |
|
|
430616 |
135170682 |
1 |
S2O5N7H29C39 |
A2B5C7D29E39 |
-6.08 |
3.79 |
-8.84 |
-1.35 |
0 |
|
|
430617 |
135170683 |
1 |
NO3C9H13 |
AB3C9D13 |
-87.71 |
2.8 |
-10.17 |
0.1 |
0 |
|
|
430618 |
135170684 |
1 |
ClN3C10H10 |
AB3C10D10 |
52.6 |
1.6 |
-9.26 |
-0.79 |
0 |
|
|
430619 |
135170685 |
2 |
NOC4H6 |
ABC4D6 |
-46.82 |
2.32 |
-10.26 |
-0.15 |
0 |
|
|
430620 |
135170686 |
1 |
NO4C11H17 |
AB4C11D17 |
-167.76 |
4.43 |
-9.86 |
-0.88 |
0 |
|
|
430621 |
135170687 |
1 |
NO4C11H17 |
AB4C11D17 |
-170.27 |
4.58 |
-9.86 |
-0.82 |
0 |
|
|
430622 |
135170688 |
1 |
ON2C8H8 |
AB2C8D8 |
61.03 |
0.86 |
-10.34 |
-0.37 |
0 |
|
|
430623 |
135170689 |
1 |
NOC10H15 |
ABC10D15 |
4.63 |
3.06 |
-9.98 |
0.31 |
0 |
|
|
430624 |
135170690 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-49.07 |
2.54 |
-8.61 |
-0.34 |
0 |
|
|
430625 |
135170691 |
1 |
SO2N3C8H9 |
AB2C3D8E9 |
-34.09 |
6.38 |
-9.11 |
-1.27 |
0 |
|
|
430626 |
135170692 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-35.18 |
1.84 |
-8.75 |
-1.2 |
0 |
|
|
430627 |
135170693 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-64.91 |
2.55 |
-9.0 |
-0.31 |
0 |
|
|
430628 |
135170694 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-49.49 |
3.9 |
-8.48 |
-0.34 |
0 |
|
|
430629 |
135170695 |
1 |
SO2N3C8H9 |
AB2C3D8E9 |
-32.37 |
5.73 |
-9.15 |
-1.32 |
0 |
|
|
430630 |
135170696 |
1 |
NO3C11H17 |
AB3C11D17 |
-134.22 |
4.34 |
-9.74 |
-0.5 |
0 |