List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
55601 |
17395640 |
1 |
OSN5C13H13 |
ABC5D13E13 |
112.52 |
4.69 |
-9.48 |
-1.1 |
0 |
|
|
55602 |
17395641 |
1 |
ClN3O3C24H24 |
AB3C3D24E24 |
-65.82 |
1.76 |
-8.47 |
-0.7 |
0 |
|
|
55603 |
17395642 |
1 |
ClO2N3C26H26 |
AB2C3D26E26 |
-9.5 |
4.83 |
-8.47 |
-0.14 |
0 |
|
|
55604 |
17395643 |
1 |
S2N3O3C22H23 |
A2B3C3D22E23 |
-58.3 |
7.79 |
-8.27 |
-0.52 |
0 |
|
|
55605 |
17395645 |
1 |
N2O3C24H26 |
A2B3C24D26 |
-65.65 |
2.58 |
-8.33 |
0.13 |
0 |
|
|
55606 |
17395650 |
1 |
FO2N6H13C16 |
AB2C6D13E16 |
-11.97 |
1.67 |
-8.76 |
-0.81 |
0 |
|
|
55607 |
17395652 |
1 |
N3O4C20H23 |
A3B4C20D23 |
-131.32 |
1.3 |
-8.76 |
-0.6 |
0 |
|
|
55608 |
17395654 |
1 |
OSN3C20H21 |
ABC3D20E21 |
30.13 |
3.17 |
-8.61 |
-0.96 |
0 |
|
|
55609 |
17395655 |
1 |
FN2O3C18H19 |
AB2C3D18E19 |
-151.84 |
2.13 |
-9.54 |
-0.19 |
0 |
|
|
55610 |
17395657 |
1 |
FN2O4C17H19 |
AB2C4D17E19 |
-159.05 |
6.25 |
-8.41 |
-0.24 |
0 |
|
|
55611 |
17395662 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-44.45 |
3.28 |
-8.3 |
0.13 |
0 |
|
|
55612 |
17395664 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-40.51 |
3.18 |
-7.96 |
0.12 |
0 |
|
|
55613 |
17395666 |
1 |
ON4C19H20 |
AB4C19D20 |
46.33 |
3.4 |
-8.57 |
-0.82 |
0 |
|
|
55614 |
17395667 |
1 |
ClFNO3H11C17 |
ABCD3E11F17 |
-105.76 |
7.71 |
-9.43 |
-1.48 |
0 |
|
|
55615 |
17395669 |
1 |
NOF2H13C15 |
ABC2D13E15 |
-99.66 |
4.52 |
-8.65 |
-0.89 |
0 |
|
|
55616 |
17395670 |
1 |
FN2O4C20H21 |
AB2C4D20E21 |
-164.27 |
2.43 |
-9.03 |
-0.33 |
0 |
|
|
55617 |
17395676 |
1 |
SO3N4C22H26 |
AB3C4D22E26 |
-81.82 |
1.52 |
-8.95 |
-0.61 |
0 |
|
|
55618 |
17395679 |
1 |
SO2N3H17C20 |
AB2C3D17E20 |
40.48 |
4.96 |
-9.02 |
-0.87 |
0 |
|
|
55619 |
17395680 |
1 |
OSN3H15C19 |
ABC3D15E19 |
72.53 |
5.95 |
-9.12 |
-1.18 |
0 |
|
|
55620 |
17395684 |
1 |
F3N6H13C16 |
A3B6C13D16 |
-22.0 |
11.68 |
-8.98 |
-1.21 |
0 |
|
|
55621 |
17395685 |
1 |
ClOSN2H13C14 |
ABCD2E13F14 |
7.2 |
4.82 |
-9.1 |
-0.77 |
0 |
|
|
55622 |
17395686 |
1 |
SN3O5C26H31 |
AB3C5D26E31 |
-201.63 |
1.86 |
-9.48 |
-1.2 |
0 |
|
|
55623 |
17395687 |
1 |
ClOSN8H15C18 |
ABCD8E15F18 |
119.52 |
1.92 |
-9.3 |
-1.11 |
0 |
|
|
55624 |
17395688 |
1 |
OSN4C17H20 |
ABC4D17E20 |
45.33 |
7.42 |
-8.45 |
-0.46 |
0 |
|
|
55625 |
17395689 |
1 |
N2O5C16H22 |
A2B5C16D22 |
-221.26 |
4.42 |
-9.55 |
-0.38 |
0 |
|
|
55626 |
17395690 |
1 |
N2O5C18H26 |
A2B5C18D26 |
-241.7 |
3.23 |
-9.66 |
-0.46 |
0 |
|
|
55627 |
17395691 |
1 |
N2O5C18H26 |
A2B5C18D26 |
-232.51 |
5.0 |
-9.3 |
-0.36 |
0 |
|
|
55628 |
17395692 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-191.45 |
3.43 |
-9.33 |
-0.15 |
0 |
|
|
55629 |
17395693 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-195.88 |
2.19 |
-9.2 |
-0.39 |
0 |
|
|
55630 |
17395694 |
1 |
N3O4C19H21 |
A3B4C19D21 |
-107.6 |
3.89 |
-8.73 |
-0.05 |
0 |
|
|
55631 |
17395695 |
1 |
SO3N5C17H19 |
AB3C5D17E19 |
-48.39 |
2.4 |
-9.3 |
-1.24 |
0 |
|
|
55632 |
17395698 |
1 |
NO6C16H17 |
AB6C16D17 |
-210.84 |
2.5 |
-9.54 |
-0.43 |
0 |
|
|
55633 |
17395700 |
1 |
OSN3C16H21 |
ABC3D16E21 |
-0.5 |
6.4 |
-8.69 |
-0.16 |
0 |
|
|
55634 |
17395701 |
1 |
BrSN3C12H14 |
ABC3D12E14 |
57.68 |
5.59 |
-8.67 |
-0.41 |
0 |
|
|
55635 |
17395703 |
1 |
ClFOSN4C13H14 |
ABCDE4F13G14 |
-40.24 |
5.91 |
-8.99 |
-0.45 |
0 |
|
|
55636 |
17395704 |
1 |
OSN4C15H20 |
ABC4D15E20 |
-2.08 |
4.96 |
-8.47 |
-0.25 |
0 |
|
|
55637 |
17395705 |
1 |
OSN4C15H16 |
ABC4D15E16 |
55.8 |
3.9 |
-8.75 |
-0.67 |
0 |
|
|
55638 |
17395706 |
1 |
OS2N4C16H16 |
AB2C4D16E16 |
56.92 |
5.31 |
-9.04 |
-0.88 |
0 |
|
|
55639 |
17395707 |
1 |
OS2N5H15C16 |
AB2C5D15E16 |
86.81 |
2.04 |
-8.78 |
-0.85 |
0 |
|
|
55640 |
17395709 |
1 |
OS2N4C13H18 |
AB2C4D13E18 |
13.27 |
5.04 |
-9.09 |
-0.34 |
0 |
|
|
55641 |
17395710 |
1 |
OS2N4C18H20 |
AB2C4D18E20 |
43.45 |
5.08 |
-8.9 |
-0.76 |
0 |
|
|
55642 |
17395712 |
1 |
N2S2O3C17H20 |
A2B2C3D17E20 |
-105.38 |
7.42 |
-9.05 |
-1.03 |
0 |
|
|
55643 |
17395714 |
1 |
SO2N3C17H17 |
AB2C3D17E17 |
5.63 |
4.22 |
-8.58 |
-0.61 |
0 |
|
|
55644 |
17395717 |
1 |
ClS2O3N4C17H21 |
AB2C3D4E17F21 |
-73.49 |
3.87 |
-8.59 |
-1.13 |
0 |
|
|
55645 |
17395726 |
1 |
N3O4C17H17 |
A3B4C17D17 |
-84.8 |
7.15 |
-9.3 |
-1.03 |
0 |
|
|
55646 |
17395730 |
3 |
NOC7H9 |
ABC7D9 |
-93.73 |
2.72 |
-8.96 |
0.13 |
0 |
|
|
55647 |
17395731 |
1 |
ON3C17H19 |
AB3C17D19 |
0.06 |
2.14 |
-8.74 |
-0.42 |
0 |
|
|
55648 |
17395736 |
1 |
OSN4H12C14 |
ABC4D12E14 |
46.45 |
3.33 |
-8.83 |
-1.52 |
0 |
|
|
55649 |
17395738 |
1 |
FO2N3H14C18 |
AB2C3D14E18 |
-39.11 |
3.98 |
-9.27 |
-1.08 |
0 |
|
|
55650 |
17395740 |
1 |
OSN3H13C15 |
ABC3D13E15 |
31.92 |
2.93 |
-8.65 |
-1.08 |
0 |
|
|
55651 |
17395741 |
1 |
FOSN2C13H13 |
ABCD2E13F13 |
-36.72 |
5.07 |
-9.33 |
-0.7 |
0 |
|
|
55652 |
17395742 |
1 |
FO2N3H14C17 |
AB2C3D14E17 |
-40.03 |
2.64 |
-8.92 |
-0.95 |
0 |
|
|
55653 |
17395743 |
1 |
F2N4O4H20C21 |
A2B4C4D20E21 |
-209.55 |
8.68 |
-9.15 |
-1.11 |
0 |
|
|
55654 |
17395744 |
1 |
ClO2S2N5H14C17 |
AB2C2D5E14F17 |
53.48 |
12.08 |
-8.26 |
-1.58 |
0 |
|
|
55655 |
17395745 |
1 |
SN2O3C12H18 |
AB2C3D12E18 |
-110.06 |
2.38 |
-9.9 |
-0.95 |
0 |
|
|
55656 |
17395746 |
1 |
SN7C14H17 |
AB7C14D17 |
136.78 |
2.76 |
-8.51 |
-0.71 |
0 |
|
|
55657 |
17395747 |
1 |
SN2O3C14H16 |
AB2C3D14E16 |
-73.73 |
2.77 |
-8.78 |
-1.37 |
0 |
|
|
55658 |
17395748 |
1 |
N3H13C17 |
A3B13C17 |
106.96 |
1.67 |
-8.54 |
-0.74 |
0 |
|
|
55659 |
17395749 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-73.75 |
4.16 |
-8.98 |
0.01 |
0 |
|
|
55660 |
17395750 |
1 |
BrO2N3C15H18 |
AB2C3D15E18 |
-19.59 |
6.08 |
-8.43 |
-0.42 |
0 |
|
|
55661 |
17395751 |
1 |
SN7C16H21 |
AB7C16D21 |
106.05 |
2.72 |
-8.44 |
-0.59 |
0 |
|
|
55662 |
17395755 |
1 |
N2O5H18C20 |
A2B5C18D20 |
-122.94 |
1.25 |
-9.11 |
-0.5 |
0 |
|
|
55663 |
17395756 |
2 |
NO2H8C9 |
AB2C8D9 |
-31.55 |
3.0 |
-9.1 |
-1.53 |
0 |
|
|
55664 |
17395757 |
1 |
N2O5H18C20 |
A2B5C18D20 |
-116.72 |
4.65 |
-8.79 |
-0.56 |
0 |
|
|
55665 |
17395758 |
1 |
S2O3N4C19H26 |
A2B3C4D19E26 |
-82.97 |
7.87 |
-8.97 |
-1.1 |
0 |
|
|
55666 |
17395766 |
1 |
FON3C22H24 |
ABC3D22E24 |
-33.44 |
3.5 |
-8.56 |
-0.11 |
0 |
|
|
55667 |
17395767 |
1 |
ClN2O3H15C19 |
AB2C3D15E19 |
-52.56 |
4.75 |
-8.64 |
-1.11 |
0 |
|
|
55668 |
17395768 |
1 |
ClN2O4H15C18 |
AB2C4D15E18 |
-80.89 |
6.09 |
-8.59 |
-1.55 |
0 |
|
|
55669 |
17395769 |
1 |
ClO2N3C20H22 |
AB2C3D20E22 |
-31.32 |
4.53 |
-9.29 |
-0.36 |
0 |
|
|
55670 |
17395773 |
1 |
SO2F3N4C15H17 |
AB2C3D4E15F17 |
-209.83 |
4.69 |
-9.2 |
-0.89 |
0 |
|
|
55671 |
17395779 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-40.46 |
2.39 |
-9.15 |
0.08 |
0 |
|
|
55672 |
17395781 |
1 |
OSN2C15H16 |
ABC2D15E16 |
8.49 |
3.16 |
-9.01 |
-0.12 |
0 |
|
|
55673 |
17395783 |
1 |
OSN5C19H23 |
ABC5D19E23 |
69.4 |
7.25 |
-8.24 |
-1.0 |
0 |
|
|
55674 |
17395787 |
1 |
OSN5H17C18 |
ABC5D17E18 |
77.1 |
4.37 |
-8.7 |
-0.67 |
0 |
|
|
55675 |
17395788 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
-38.66 |
3.64 |
-8.49 |
-0.73 |
0 |
|
|
55676 |
17395805 |
1 |
ClON3C19H22 |
ABC3D19E22 |
-3.07 |
4.71 |
-8.56 |
0.06 |
0 |
|
|
55677 |
17395806 |
1 |
N2O4C17H20 |
A2B4C17D20 |
-105.52 |
6.54 |
-9.37 |
-0.87 |
0 |
|
|
55678 |
17395807 |
1 |
FO2N3H18C19 |
AB2C3D18E19 |
-36.78 |
5.09 |
-9.03 |
-0.51 |
0 |
|
|
55679 |
17395808 |
1 |
SN2O3H12C15 |
AB2C3D12E15 |
-40.13 |
6.35 |
-9.22 |
-1.41 |
0 |
|
|
55680 |
17395809 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-60.2 |
4.27 |
-8.78 |
-0.34 |
0 |
|
|
55681 |
17395812 |
1 |
N3O3C19H19 |
A3B3C19D19 |
-60.71 |
3.08 |
-9.01 |
-1.12 |
0 |
|
|
55682 |
17395814 |
1 |
N2O4C15H18 |
A2B4C15D18 |
-86.69 |
8.21 |
-8.99 |
-0.15 |
0 |
|
|
55683 |
17395829 |
1 |
OSN5C19H23 |
ABC5D19E23 |
89.91 |
6.68 |
-8.16 |
-0.8 |
0 |
|
|
55684 |
17395833 |
1 |
SCl2N2O2H14C16 |
AB2C2D2E14F16 |
-40.7 |
2.14 |
-9.48 |
-0.96 |
0 |
|
|
55685 |
17395836 |
1 |
SO3N4C18H20 |
AB3C4D18E20 |
-96.43 |
0.88 |
-9.28 |
-0.97 |
0 |
|
|
55686 |
17395837 |
1 |
O2S2N3C14H15 |
A2B2C3D14E15 |
-47.89 |
3.99 |
-8.98 |
-0.86 |
0 |
|
|
55687 |
17395838 |
1 |
ON2S2C12H14 |
AB2C2D12E14 |
-16.18 |
2.77 |
-8.83 |
-0.71 |
0 |
|
|
55688 |
17395839 |
1 |
O2S2N3C9H11 |
A2B2C3D9E11 |
-50.79 |
4.41 |
-9.07 |
-0.85 |
0 |
|
|
55689 |
17395840 |
1 |
ON2S2C13H16 |
AB2C2D13E16 |
-19.96 |
4.73 |
-8.84 |
-0.88 |
0 |
|
|
55690 |
17395841 |
1 |
ClN3O3C18H18 |
AB3C3D18E18 |
-0.39 |
4.44 |
-9.14 |
-1.58 |
0 |
|
|
55691 |
17395847 |
1 |
NSO3C21H25 |
ABC3D21E25 |
-99.25 |
3.62 |
-9.57 |
-0.55 |
0 |
|
|
55692 |
17395848 |
1 |
FNS2O3C17H20 |
ABC2D3E17F20 |
-156.7 |
4.08 |
-9.04 |
-1.14 |
0 |
|
|
55693 |
17395849 |
1 |
SN2O3C17H18 |
AB2C3D17E18 |
-85.99 |
2.67 |
-8.62 |
-0.57 |
0 |
|
|
55694 |
17395850 |
1 |
N3O3H17C18 |
A3B3C17D18 |
-38.83 |
2.42 |
-8.67 |
-1.09 |
0 |
|
|
55695 |
17395851 |
1 |
ON3C18H23 |
AB3C18D23 |
5.84 |
3.23 |
-9.15 |
-0.58 |
0 |
|
|
55696 |
17395852 |
1 |
SN2O3C19H22 |
AB2C3D19E22 |
-86.55 |
9.2 |
-9.16 |
-0.6 |
0 |
|
|
55697 |
17395855 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-113.68 |
2.95 |
-8.44 |
0.36 |
0 |
|
|
55698 |
17395857 |
1 |
SN2O2C16H16 |
AB2C2D16E16 |
-18.07 |
4.03 |
-8.99 |
-0.29 |
0 |
|
|
55699 |
17395860 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-36.23 |
2.33 |
-8.96 |
-0.14 |
0 |
|
|
55700 |
17395862 |
1 |
Cl2O2N3C17H21 |
A2B2C3D17E21 |
-89.18 |
4.68 |
-9.3 |
-0.28 |
0 |