List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126736 |
50975897 |
1 |
FN2O2C13H15 |
AB2C2D13E15 |
-51.83 |
3.04 |
-9.75 |
-0.34 |
0 |
|
|
126737 |
50975903 |
1 |
O2N3H15C17 |
A2B3C15D17 |
9.45 |
4.07 |
-9.33 |
-1.01 |
0 |
|
|
126738 |
50976017 |
2 |
ON2C10H10 |
AB2C10D10 |
51.97 |
4.24 |
-8.57 |
-0.7 |
0 |
|
|
126739 |
50976067 |
2 |
SN3C6H7 |
AB3C6D7 |
103.27 |
4.87 |
-8.5 |
-0.57 |
0 |
|
|
126740 |
50976242 |
1 |
SN5C14H17 |
AB5C14D17 |
81.64 |
3.05 |
-8.7 |
-0.78 |
0 |
|
|
126741 |
50976282 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-24.81 |
8.6 |
-8.47 |
-0.19 |
0 |
|
|
126742 |
50976320 |
1 |
ClON3C15H18 |
ABC3D15E18 |
-8.05 |
2.23 |
-9.51 |
-0.28 |
0 |
|
|
126743 |
50976353 |
1 |
NSF3O5C14H16 |
ABC3D5E14F16 |
-352.17 |
2.04 |
-9.98 |
-1.55 |
0 |
|
|
126744 |
50976667 |
1 |
ON5C16H17 |
AB5C16D17 |
103.88 |
3.19 |
-9.74 |
-0.81 |
0 |
|
|
126745 |
50976668 |
1 |
F3N3O3C12H16 |
A3B3C3D12E16 |
-204.56 |
6.72 |
-10.24 |
-0.59 |
0 |
|
|
126746 |
50976669 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-10.33 |
5.29 |
-9.42 |
0.07 |
0 |
|
|
126747 |
50976670 |
1 |
O2N7C18H21 |
A2B7C18D21 |
-7.29 |
7.53 |
-9.08 |
-0.47 |
0 |
|
|
126748 |
50976671 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-27.23 |
1.53 |
-9.22 |
-0.43 |
0 |
|
|
126749 |
50976672 |
1 |
N2O5C18H26 |
A2B5C18D26 |
-222.53 |
3.02 |
-8.79 |
-0.56 |
0 |
|
|
126750 |
50976673 |
2 |
NO2C11H12 |
AB2C11D12 |
-87.14 |
4.82 |
-8.86 |
-0.25 |
0 |
|
|
126751 |
50976674 |
2 |
N2C9H11 |
A2B9C11 |
80.62 |
3.1 |
-8.82 |
-0.5 |
0 |
|
|
126752 |
50976747 |
1 |
ClO2N3H20C22 |
AB2C3D20E22 |
-25.78 |
2.53 |
-9.21 |
-0.75 |
0 |
|
|
126753 |
50976827 |
1 |
NO4C21H29 |
AB4C21D29 |
-190.68 |
4.0 |
-8.83 |
-0.2 |
0 |
|
|
126754 |
50976836 |
1 |
ClO2N4C10H11 |
AB2C4D10E11 |
-22.04 |
5.9 |
-8.81 |
-0.38 |
0 |
|
|
126755 |
50976888 |
1 |
N7H19C20 |
A7B19C20 |
171.09 |
3.82 |
-9.32 |
-1.45 |
0 |
|
|
126756 |
50976889 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-117.46 |
4.8 |
-8.93 |
-0.89 |
0 |
|
|
126757 |
50977001 |
2 |
ON3H8C9 |
AB3C8D9 |
29.73 |
7.18 |
-8.68 |
-0.94 |
0 |
|
|
126758 |
50977163 |
1 |
OSN5C18H31 |
ABC5D18E31 |
-37.36 |
3.14 |
-8.88 |
-0.23 |
0 |
|
|
126759 |
50977220 |
1 |
ON4C16H26 |
AB4C16D26 |
-46.13 |
7.26 |
-8.86 |
0.08 |
0 |
|
|
126760 |
50977277 |
1 |
OSN3C17H19 |
ABC3D17E19 |
18.18 |
3.31 |
-8.45 |
-0.54 |
0 |
|
|
126761 |
50977325 |
1 |
ON6C23H24 |
AB6C23D24 |
86.95 |
4.5 |
-8.88 |
-0.4 |
0 |
|
|
126762 |
50977402 |
1 |
O2N5C19H21 |
A2B5C19D21 |
34.88 |
4.89 |
-9.3 |
-0.54 |
0 |
|
|
126763 |
50977403 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-115.58 |
0.37 |
-9.14 |
0.3 |
0 |
|
|
126764 |
50977404 |
1 |
OF3N4C11H11 |
AB3C4D11E11 |
-143.47 |
5.11 |
-9.58 |
-1.02 |
0 |
|
|
126765 |
50977405 |
2 |
NO2C10H12 |
AB2C10D12 |
-144.34 |
5.73 |
-8.37 |
-0.21 |
0 |
|
|
126766 |
50977461 |
1 |
ClN5H20C21 |
AB5C20D21 |
107.76 |
6.67 |
-8.46 |
-0.68 |
0 |
|
|
126767 |
50977573 |
1 |
ON6C18H20 |
AB6C18D20 |
71.97 |
6.57 |
-9.46 |
-1.24 |
0 |
|
|
126768 |
50977589 |
1 |
O2N5C19H19 |
A2B5C19D19 |
62.0 |
6.52 |
-9.25 |
-0.92 |
0 |
|
|
126769 |
50977691 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-54.43 |
4.08 |
-8.32 |
-0.7 |
0 |
|
|
126770 |
50977709 |
1 |
N2S2O3C16H18 |
A2B2C3D16E18 |
-67.51 |
5.18 |
-8.67 |
-0.67 |
0 |
|
|
126771 |
50977764 |
1 |
OSN5C17H19 |
ABC5D17E19 |
73.72 |
9.97 |
-8.89 |
-0.62 |
0 |
|
|
126772 |
50977861 |
1 |
N4H10C15 |
A4B10C15 |
141.15 |
4.6 |
-9.26 |
-1.4 |
0 |
|
|
126773 |
50977914 |
3 |
NOC6H9 |
ABC6D9 |
-141.04 |
8.4 |
-9.2 |
-0.43 |
0 |
|
|
126774 |
50977961 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-85.06 |
3.83 |
-9.28 |
-0.5 |
0 |
|
|
126775 |
50977962 |
1 |
SO3N4C16H22 |
AB3C4D16E22 |
-55.64 |
3.5 |
-9.4 |
-0.96 |
0 |
|
|
126776 |
50977963 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-124.96 |
2.61 |
-9.5 |
0.16 |
0 |
|
|
126777 |
50978111 |
1 |
O3N4C16H22 |
A3B4C16D22 |
-89.86 |
4.07 |
-9.03 |
0.04 |
0 |
|
|
126778 |
50978261 |
1 |
ON5C18H25 |
AB5C18D25 |
5.21 |
4.87 |
-9.16 |
0.53 |
0 |
|
|
126779 |
50978273 |
1 |
OSN8C10H14 |
ABC8D10E14 |
85.2 |
6.03 |
-9.38 |
-1.03 |
0 |
|
|
126780 |
50978371 |
1 |
N7C20H31 |
A7B20C31 |
59.57 |
2.83 |
-8.83 |
-0.64 |
0 |
|
|
126781 |
50978372 |
1 |
F2N3O4C15H15 |
A2B3C4D15E15 |
-228.96 |
3.04 |
-9.38 |
-0.72 |
0 |
|
|
126782 |
50978436 |
1 |
SO3N4C12H20 |
AB3C4D12E20 |
-107.3 |
3.36 |
-9.02 |
-0.28 |
0 |
|
|
126783 |
50978462 |
1 |
O2N4C15H18 |
A2B4C15D18 |
5.73 |
7.17 |
-8.9 |
-0.24 |
0 |
|
|
126784 |
50978463 |
1 |
ON4C20H28 |
AB4C20D28 |
-17.49 |
4.42 |
-9.27 |
0.24 |
0 |
|
|
126785 |
50978464 |
2 |
ON2H8C9 |
AB2C8D9 |
48.14 |
9.61 |
-7.56 |
-1.18 |
0 |
|
|
126786 |
50978465 |
1 |
ON4C23H28 |
AB4C23D28 |
39.2 |
4.61 |
-8.21 |
-0.3 |
0 |
|
|
126787 |
50978500 |
1 |
N9H17C20 |
A9B17C20 |
249.5 |
8.17 |
-8.29 |
-1.7 |
0 |
|
|
126788 |
50978728 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-35.37 |
5.24 |
-8.97 |
0.72 |
0 |
|
|
126789 |
50978888 |
1 |
SN2O3C15H24 |
AB2C3D15E24 |
-135.77 |
4.03 |
-9.03 |
0.28 |
0 |
|
|
126790 |
50978988 |
1 |
OF2N2C12H12 |
AB2C2D12E12 |
-88.43 |
1.91 |
-9.43 |
-1.0 |
0 |
|
|
126791 |
50979094 |
1 |
ON4C19H24 |
AB4C19D24 |
41.7 |
2.28 |
-8.55 |
-0.41 |
0 |
|
|
126792 |
50979172 |
1 |
ON5C14H23 |
AB5C14D23 |
-32.51 |
1.6 |
-8.46 |
0.4 |
0 |
|
|
126793 |
50979249 |
1 |
OSN4C15H20 |
ABC4D15E20 |
14.93 |
3.37 |
-9.36 |
-0.45 |
0 |
|
|
126794 |
50979344 |
1 |
ClON4C19H21 |
ABC4D19E21 |
42.05 |
5.75 |
-8.75 |
-0.53 |
0 |
|
|
126795 |
50979345 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-14.57 |
5.03 |
-9.0 |
0.03 |
0 |
|
|
126796 |
50979346 |
1 |
NO2C17H27 |
AB2C17D27 |
-89.87 |
3.22 |
-9.2 |
1.08 |
0 |
|
|
126797 |
50979373 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-41.81 |
3.74 |
-9.56 |
-0.59 |
0 |
|
|
126798 |
50979374 |
1 |
N3O5H17C19 |
A3B5C17D19 |
-120.69 |
6.74 |
-9.39 |
-1.04 |
0 |
|
|
126799 |
50979445 |
1 |
O2N3C15H29 |
A2B3C15D29 |
-106.73 |
4.31 |
-8.94 |
1.15 |
0 |
|
|
126800 |
50979493 |
1 |
O2N5C16H23 |
A2B5C16D23 |
-61.0 |
5.28 |
-9.54 |
-0.69 |
0 |
|
|
126801 |
50979569 |
1 |
ON2C24H26 |
AB2C24D26 |
22.74 |
1.83 |
-8.98 |
-0.6 |
0 |
|
|
126802 |
50979570 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-150.45 |
5.85 |
-9.18 |
-0.59 |
0 |
|
|
126803 |
50979571 |
1 |
FON2H13C16 |
ABC2D13E16 |
-2.06 |
3.98 |
-8.72 |
-0.58 |
0 |
|
|
126804 |
50979604 |
1 |
ClN3O3C18H24 |
AB3C3D18E24 |
-123.02 |
6.3 |
-9.04 |
-0.22 |
0 |
|
|
126805 |
50979702 |
1 |
ON5H19C22 |
AB5C19D22 |
92.54 |
7.4 |
-8.77 |
-1.1 |
0 |
|
|
126806 |
50979734 |
1 |
O2N5H19C20 |
A2B5C19D20 |
19.28 |
1.14 |
-9.35 |
-0.71 |
0 |
|
|
126807 |
50979735 |
1 |
SN4C10H18 |
AB4C10D18 |
23.46 |
6.35 |
-8.22 |
0.19 |
0 |
|
|
126808 |
50979736 |
1 |
OSN5C17H19 |
ABC5D17E19 |
58.96 |
6.19 |
-8.87 |
-1.25 |
0 |
|
|
126809 |
50979789 |
1 |
NO5C22H25 |
AB5C22D25 |
-153.6 |
4.17 |
-8.27 |
-0.23 |
0 |
|
|
126810 |
50979804 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-5.62 |
3.5 |
-9.16 |
-0.8 |
0 |
|
|
126811 |
50979932 |
1 |
O2N5C20H23 |
A2B5C20D23 |
24.88 |
7.43 |
-7.87 |
-1.36 |
0 |
|
|
126812 |
50979968 |
1 |
ON7H17C20 |
AB7C17D20 |
137.33 |
6.9 |
-9.39 |
-1.08 |
0 |
|
|
126813 |
50980015 |
1 |
SO3N4C19H24 |
AB3C4D19E24 |
-63.78 |
5.02 |
-9.21 |
-0.22 |
0 |
|
|
126814 |
50980016 |
1 |
ON4C16H26 |
AB4C16D26 |
-33.56 |
6.52 |
-8.93 |
0.49 |
0 |
|
|
126815 |
50980017 |
1 |
NO2C17H25 |
AB2C17D25 |
-79.96 |
2.7 |
-9.39 |
0.21 |
0 |
|
|
126816 |
50980063 |
1 |
N6C17H20 |
A6B17C20 |
124.68 |
5.98 |
-8.53 |
-0.84 |
0 |
|
|
126817 |
50980064 |
1 |
O2S2N3C15H17 |
A2B2C3D15E17 |
-21.79 |
5.65 |
-8.71 |
-0.53 |
0 |
|
|
126818 |
50980065 |
1 |
SN4C21H32 |
AB4C21D32 |
33.79 |
4.34 |
-8.75 |
-0.07 |
0 |
|
|
126819 |
50980066 |
1 |
ON4C16H26 |
AB4C16D26 |
-27.66 |
3.86 |
-8.58 |
0.18 |
0 |
|
|
126820 |
50980067 |
1 |
O2N6C19H32 |
A2B6C19D32 |
-45.09 |
6.03 |
-8.57 |
-0.18 |
0 |
|
|
126821 |
50980068 |
2 |
ON2C9H10 |
AB2C9D10 |
24.86 |
4.92 |
-8.52 |
-0.25 |
0 |
|
|
126822 |
50980141 |
1 |
ON6C20H26 |
AB6C20D26 |
36.39 |
4.51 |
-9.13 |
-0.32 |
0 |
|
|
126823 |
50980142 |
1 |
ON5C15H27 |
AB5C15D27 |
-22.49 |
2.86 |
-8.5 |
0.09 |
0 |
|
|
126824 |
50980143 |
1 |
N3O4C13H17 |
A3B4C13D17 |
-118.02 |
6.3 |
-8.93 |
-0.21 |
0 |
|
|
126825 |
50980184 |
1 |
SN2O2C17H22 |
AB2C2D17E22 |
-39.9 |
9.3 |
-9.11 |
-0.32 |
0 |
|
|
126826 |
50980195 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-3.23 |
4.65 |
-8.76 |
-1.2 |
0 |
|
|
126827 |
50980202 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-108.84 |
5.95 |
-8.71 |
-0.54 |
0 |
|
|
126828 |
50980204 |
2 |
ON2C10H10 |
AB2C10D10 |
-0.97 |
9.68 |
-9.21 |
-0.53 |
0 |
|
|
126829 |
50980312 |
1 |
NO4C22H23 |
AB4C22D23 |
-51.51 |
1.52 |
-8.57 |
-0.41 |
0 |
|
|
126830 |
50980346 |
1 |
SN2H10C13 |
AB2C10D13 |
71.44 |
3.46 |
-8.55 |
-0.47 |
0 |
|
|
126831 |
50980350 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-33.83 |
5.48 |
-9.49 |
-0.62 |
0 |
|
|
126832 |
50980386 |
2 |
NOC9H12 |
ABC9D12 |
-49.28 |
4.12 |
-8.47 |
-0.38 |
0 |
|
|
126833 |
50980423 |
2 |
NOC10H11 |
ABC10D11 |
-9.09 |
7.38 |
-8.84 |
-0.62 |
0 |
|
|
126834 |
50980505 |
1 |
ON5C19H23 |
AB5C19D23 |
22.88 |
2.95 |
-7.95 |
-0.14 |
0 |
|
|
126835 |
50980715 |
1 |
F2N3O3C20H21 |
A2B3C3D20E21 |
-167.36 |
4.52 |
-8.9 |
-0.88 |
0 |