List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
349785 |
127276177 |
1 |
SN2O3C14H22 |
AB2C3D14E22 |
-120.56 |
5.13 |
-9.08 |
-0.14 |
0 |
|
|
349786 |
127276178 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-129.88 |
3.11 |
-8.68 |
0.1 |
0 |
|
|
349787 |
127276179 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-78.75 |
5.9 |
-9.32 |
-0.81 |
0 |
|
|
349788 |
127276180 |
1 |
N2O4C17H28 |
A2B4C17D28 |
-191.21 |
5.38 |
-9.44 |
0.85 |
0 |
|
|
349789 |
127276181 |
1 |
N2O3C18H26 |
A2B3C18D26 |
-116.74 |
3.56 |
-7.82 |
0.37 |
0 |
|
|
349790 |
127276182 |
1 |
N2O4C19H26 |
A2B4C19D26 |
-176.26 |
8.8 |
-8.95 |
-0.12 |
0 |
|
|
349791 |
127276183 |
1 |
NO2C14H25 |
AB2C14D25 |
-124.15 |
4.37 |
-9.17 |
1.18 |
0 |
|
|
349792 |
127276184 |
1 |
FN3O3C19H22 |
AB3C3D19E22 |
-99.86 |
7.01 |
-9.65 |
-0.92 |
0 |
|
|
349793 |
127276185 |
1 |
N2O4C17H28 |
A2B4C17D28 |
-172.16 |
6.83 |
-9.42 |
0.95 |
0 |
|
|
349794 |
127276186 |
1 |
N3O3C14H19 |
A3B3C14D19 |
-111.64 |
4.03 |
-9.19 |
-0.34 |
0 |
|
|
349795 |
127276187 |
1 |
SN2O3C12H20 |
AB2C3D12E20 |
-125.57 |
9.05 |
-8.92 |
0.04 |
0 |
|
|
349796 |
127276188 |
2 |
N2O2C9H13 |
A2B2C9D13 |
-152.17 |
2.78 |
-8.35 |
-0.24 |
0 |
|
|
349797 |
127276189 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-161.55 |
0.8 |
-9.76 |
-0.48 |
0 |
|
|
349798 |
127276190 |
1 |
SN2O3C17H28 |
AB2C3D17E28 |
-163.93 |
6.19 |
-8.9 |
0.36 |
0 |
|
|
349799 |
127276191 |
1 |
ClN3O3C19H22 |
AB3C3D19E22 |
-62.59 |
6.06 |
-9.53 |
-0.93 |
0 |
|
|
349800 |
127276192 |
1 |
BrO2N4C15H17 |
AB2C4D15E17 |
-24.7 |
4.19 |
-9.24 |
-0.6 |
0 |
|
|
349801 |
127276193 |
1 |
O3N6C13H20 |
A3B6C13D20 |
-52.42 |
6.56 |
-9.77 |
-0.76 |
0 |
|
|
349802 |
127276194 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-112.11 |
5.01 |
-9.04 |
1.1 |
0 |
|
|
349803 |
127276195 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-113.72 |
5.32 |
-9.22 |
0.91 |
0 |
|
|
349804 |
127276196 |
1 |
NOC13H21 |
ABC13D21 |
-61.79 |
4.0 |
-9.18 |
1.28 |
0 |
|
|
349805 |
127276197 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-118.2 |
9.23 |
-9.07 |
0.85 |
0 |
|
|
349806 |
127276198 |
1 |
NSO3C11H19 |
ABC3D11E19 |
-151.84 |
6.94 |
-9.62 |
0.78 |
0 |
|
|
349807 |
127276199 |
2 |
NOC7H12 |
ABC7D12 |
-122.7 |
8.06 |
-9.06 |
1.08 |
0 |
|
|
349808 |
127276200 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-34.82 |
5.83 |
-8.94 |
-1.04 |
0 |
|
|
349809 |
127276201 |
1 |
BrON4C17H25 |
ABC4D17E25 |
1.36 |
5.17 |
-8.45 |
-0.15 |
0 |
|
|
349810 |
127276202 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-26.11 |
5.59 |
-8.6 |
-0.52 |
0 |
|
|
349811 |
127276203 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-137.79 |
3.92 |
-8.65 |
1.06 |
0 |
|
|
349812 |
127276204 |
1 |
F2O2N3C21H29 |
A2B2C3D21E29 |
-188.05 |
4.63 |
-8.64 |
-0.45 |
0 |
|
|
349813 |
127276205 |
1 |
ClO2N4C20H29 |
AB2C4D20E29 |
-95.3 |
2.37 |
-8.67 |
-0.36 |
0 |
|
|
349814 |
127276206 |
1 |
OSN5C19H25 |
ABC5D19E25 |
18.45 |
2.63 |
-8.86 |
-1.37 |
0 |
|
|
349815 |
127276207 |
1 |
SN3O3C18H33 |
AB3C3D18E33 |
-165.08 |
0.87 |
-8.56 |
0.47 |
0 |
|
|
349816 |
127276208 |
1 |
OSN6C17H28 |
ABC6D17E28 |
29.85 |
3.47 |
-8.62 |
-0.8 |
0 |
|
|
349817 |
127276209 |
1 |
FO2N3C20H28 |
AB2C3D20E28 |
-132.84 |
5.12 |
-8.56 |
-0.62 |
0 |
|
|
349818 |
127276210 |
1 |
ON5C22H31 |
AB5C22D31 |
2.45 |
4.36 |
-8.86 |
-0.24 |
0 |
|
|
349819 |
127276211 |
1 |
ON5C21H29 |
AB5C21D29 |
8.43 |
4.66 |
-8.4 |
-0.6 |
0 |
|
|
349820 |
127276212 |
1 |
ClON5C20H26 |
ABC5D20E26 |
9.93 |
2.32 |
-8.46 |
-1.04 |
0 |
|
|
349821 |
127276213 |
1 |
OSN6C15H26 |
ABC6D15E26 |
10.87 |
4.3 |
-8.74 |
-0.72 |
0 |
|
|
349822 |
127276214 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-138.67 |
2.16 |
-8.54 |
0.9 |
0 |
|
|
349823 |
127276215 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-59.93 |
2.29 |
-8.87 |
0.19 |
0 |
|
|
349824 |
127276216 |
1 |
ON4C18H24 |
AB4C18D24 |
-5.04 |
4.0 |
-8.38 |
-0.61 |
0 |
|
|
349825 |
127276217 |
1 |
ON5C21H29 |
AB5C21D29 |
8.45 |
5.21 |
-8.53 |
-0.66 |
0 |
|
|
349826 |
127276218 |
1 |
O2N4C19H34 |
A2B4C19D34 |
-130.69 |
3.81 |
-8.56 |
0.63 |
0 |
|
|
349827 |
127276219 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-125.07 |
8.01 |
-8.65 |
0.13 |
0 |
|
|
349828 |
127276220 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-60.21 |
4.86 |
-8.66 |
-1.13 |
0 |
|
|
349829 |
127276221 |
1 |
O2N3C21H37 |
A2B3C21D37 |
-142.79 |
1.27 |
-8.72 |
0.88 |
0 |
|
|
349830 |
127276222 |
1 |
ON5C22H33 |
AB5C22D33 |
-18.3 |
4.45 |
-8.77 |
-0.61 |
0 |
|
|
349831 |
127276223 |
1 |
ON5C23H33 |
AB5C23D33 |
-0.28 |
5.86 |
-8.42 |
-0.41 |
0 |
|
|
349832 |
127276224 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-85.28 |
4.44 |
-8.81 |
-0.52 |
0 |
|
|
349833 |
127276225 |
1 |
ON5C20H27 |
AB5C20D27 |
18.97 |
3.53 |
-8.5 |
-0.86 |
0 |
|
|
349834 |
127276226 |
1 |
O2N3C19H33 |
A2B3C19D33 |
-131.19 |
1.04 |
-8.57 |
0.76 |
0 |
|
|
349835 |
127276227 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-135.89 |
4.19 |
-8.54 |
1.18 |
0 |
|
|
349836 |
127276228 |
1 |
OSN6C16H22 |
ABC6D16E22 |
34.13 |
1.93 |
-8.64 |
-1.52 |
0 |
|
|
349837 |
127276229 |
1 |
ON5C21H31 |
AB5C21D31 |
-6.67 |
4.32 |
-8.9 |
-0.72 |
0 |
|
|
349838 |
127276230 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-109.44 |
4.21 |
-8.69 |
0.85 |
0 |
|
|
349839 |
127276231 |
1 |
ClON5C19H24 |
ABC5D19E24 |
24.33 |
3.51 |
-8.51 |
-1.04 |
0 |
|
|
349840 |
127276232 |
1 |
ON5C13H21 |
AB5C13D21 |
3.55 |
3.25 |
-8.59 |
-0.41 |
0 |
|
|
349841 |
127276233 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-96.04 |
6.95 |
-8.52 |
-0.22 |
0 |
|
|
349842 |
127276234 |
1 |
OSN5C18H25 |
ABC5D18E25 |
19.91 |
5.75 |
-8.66 |
-0.92 |
0 |
|
|
349843 |
127276235 |
1 |
OSN5C16H27 |
ABC5D16E27 |
-17.91 |
2.82 |
-8.64 |
-0.01 |
0 |
|
|
349844 |
127276236 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-112.16 |
7.05 |
-8.65 |
1.12 |
0 |
|
|
349845 |
127276237 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-10.5 |
7.58 |
-9.01 |
-1.06 |
0 |
|
|
349846 |
127276238 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-11.52 |
5.11 |
-8.76 |
-1.04 |
0 |
|
|
349847 |
127276239 |
1 |
ON5C20H27 |
AB5C20D27 |
19.99 |
5.8 |
-8.57 |
-0.82 |
0 |
|
|
349848 |
127276240 |
1 |
ON6C19H28 |
AB6C19D28 |
3.36 |
5.04 |
-8.57 |
-0.91 |
0 |
|
|
349849 |
127276241 |
1 |
ON5C23H27 |
AB5C23D27 |
46.67 |
5.13 |
-8.42 |
-1.21 |
0 |
|
|
349850 |
127276242 |
1 |
O2N4C19H32 |
A2B4C19D32 |
-70.65 |
5.15 |
-8.89 |
-0.14 |
0 |
|
|
349851 |
127276243 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-72.46 |
6.43 |
-8.69 |
-0.25 |
0 |
|
|
349852 |
127276244 |
2 |
ON2C10H15 |
AB2C10D15 |
-91.8 |
2.16 |
-8.64 |
0.13 |
0 |
|
|
349853 |
127276245 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-71.82 |
4.82 |
-8.71 |
-0.16 |
0 |
|
|
349854 |
127276246 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-44.93 |
7.35 |
-8.67 |
-0.62 |
0 |
|
|
349855 |
127276247 |
1 |
O2N5C22H33 |
A2B5C22D33 |
-56.12 |
8.92 |
-8.34 |
-1.11 |
0 |
|
|
349856 |
127276248 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-148.07 |
7.08 |
-9.02 |
0.71 |
0 |
|
|
349857 |
127276249 |
1 |
SN3O4C19H31 |
AB3C4D19E31 |
-196.9 |
10.83 |
-9.23 |
0.48 |
0 |
|
|
349858 |
127276250 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-120.45 |
4.24 |
-8.18 |
0.18 |
0 |
|
|
349859 |
127276251 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-152.88 |
7.69 |
-9.01 |
1.02 |
0 |
|
|
349860 |
127276252 |
1 |
ON6C19H26 |
AB6C19D26 |
46.15 |
6.44 |
-8.98 |
-0.76 |
0 |
|
|
349861 |
127276253 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-128.13 |
4.89 |
-8.66 |
-0.24 |
0 |
|
|
349862 |
127276254 |
1 |
OSN5C17H29 |
ABC5D17E29 |
-26.23 |
2.45 |
-8.57 |
-0.23 |
0 |
|
|
349863 |
127276255 |
1 |
ON4C18H24 |
AB4C18D24 |
4.84 |
6.53 |
-8.44 |
-0.76 |
0 |
|
|
349864 |
127276256 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-125.59 |
3.68 |
-8.7 |
-0.41 |
0 |
|
|
349865 |
127276257 |
2 |
ON2C10H14 |
AB2C10D14 |
-24.58 |
3.55 |
-8.88 |
-1.09 |
0 |
|
|
349866 |
127276258 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-118.12 |
7.38 |
-8.41 |
0.08 |
0 |
|
|
349867 |
127276473 |
1 |
SN3O6C17H23 |
AB3C6D17E23 |
-219.33 |
6.25 |
-9.27 |
-0.64 |
0 |
|
|
349868 |
127276474 |
1 |
O2S2N3C16H23 |
A2B2C3D16E23 |
-71.46 |
2.85 |
-9.27 |
-0.74 |
0 |
|
|
349869 |
127276475 |
1 |
ON2C14H24 |
AB2C14D24 |
-43.09 |
5.37 |
-8.92 |
1.38 |
0 |
|
|
349870 |
127276476 |
1 |
ON2C18H30 |
AB2C18D30 |
-78.81 |
3.4 |
-8.42 |
1.15 |
0 |
|
|
349871 |
127276477 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-104.1 |
6.66 |
-8.8 |
-0.56 |
0 |
|
|
349872 |
127276478 |
1 |
SN3O3C20H27 |
AB3C3D20E27 |
-106.38 |
4.87 |
-8.58 |
-0.3 |
0 |
|
|
349873 |
127276479 |
1 |
S2N3O4C15H25 |
A2B3C4D15E25 |
-175.4 |
8.65 |
-9.0 |
0.26 |
0 |
|
|
349874 |
127276480 |
1 |
SO3N6C17H22 |
AB3C6D17E22 |
-68.58 |
2.4 |
-8.63 |
-0.82 |
0 |
|
|
349875 |
127276481 |
1 |
SO2N5C19H25 |
AB2C5D19E25 |
-32.97 |
3.66 |
-8.66 |
-0.92 |
0 |
|
|
349876 |
127276482 |
1 |
SN3O3C19H25 |
AB3C3D19E25 |
-124.82 |
6.45 |
-8.64 |
-0.16 |
0 |
|
|
349877 |
127276483 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-21.31 |
3.38 |
-8.85 |
-0.95 |
0 |
|
|
349878 |
127276484 |
1 |
SN3O3C20H27 |
AB3C3D20E27 |
-123.74 |
3.46 |
-8.77 |
-0.21 |
0 |
|
|
349879 |
127276485 |
1 |
SN2O2C15H24 |
AB2C2D15E24 |
-104.9 |
5.44 |
-9.0 |
0.25 |
0 |
|
|
349880 |
127276486 |
1 |
SN3O4C19H23 |
AB3C4D19E23 |
-136.6 |
2.68 |
-8.85 |
-0.4 |
0 |
|
|
349881 |
127276686 |
1 |
SN3O4C16H27 |
AB3C4D16E27 |
-188.32 |
9.98 |
-9.49 |
0.5 |
0 |
|
|
349882 |
127276687 |
1 |
ON2C12H22 |
AB2C12D22 |
-69.81 |
4.39 |
-8.93 |
1.2 |
0 |
|
|
349883 |
127276688 |
1 |
N4O5C15H18 |
A4B5C15D18 |
-173.53 |
3.32 |
-8.56 |
-0.47 |
0 |
|
|
349884 |
127276689 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-107.04 |
5.66 |
-8.92 |
-0.23 |
0 |