List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
279775 |
103845135 |
1 |
O2N4C17H32 |
A2B4C17D32 |
-106.23 |
3.89 |
-9.24 |
0.77 |
0 |
|
|
279776 |
103845138 |
1 |
BrNC13H18 |
ABC13D18 |
22.29 |
1.15 |
-9.05 |
-0.02 |
0 |
|
|
279777 |
103845142 |
1 |
N3C14H27 |
A3B14C27 |
-4.56 |
4.04 |
-9.18 |
0.89 |
0 |
|
|
279778 |
103845149 |
1 |
OCl2N2C11H14 |
AB2C2D11E14 |
-46.17 |
4.14 |
-9.24 |
-0.33 |
0 |
|
|
279779 |
103845172 |
1 |
BrNOC14H22 |
ABCD14E22 |
-56.18 |
2.84 |
-8.98 |
-0.15 |
0 |
|
|
279780 |
103845173 |
1 |
NOCl2C13H19 |
ABC2D13E19 |
-66.55 |
3.04 |
-9.31 |
-0.55 |
0 |
|
|
279781 |
103845174 |
1 |
BrNOC15H22 |
ABCD15E22 |
-43.68 |
0.56 |
-9.04 |
-0.06 |
0 |
|
|
279782 |
103845176 |
1 |
ClFNOC14H19 |
ABCDE14F19 |
-94.5 |
3.01 |
-9.3 |
-0.46 |
0 |
|
|
279783 |
103845180 |
1 |
ON3C9H17 |
AB3C9D17 |
-22.96 |
2.73 |
-9.22 |
0.6 |
0 |
|
|
279784 |
103845181 |
1 |
ON3C12H19 |
AB3C12D19 |
-0.82 |
2.02 |
-9.31 |
0.56 |
0 |
|
|
279785 |
103845186 |
1 |
OCl2N2C16H16 |
AB2C2D16E16 |
-20.6 |
3.17 |
-8.77 |
-0.64 |
0 |
|
|
279786 |
103845187 |
1 |
OCl2N2H12C14 |
AB2C2D12E14 |
-12.43 |
5.57 |
-8.78 |
-0.8 |
0 |
|
|
279787 |
103845189 |
1 |
OCl2N3H13C14 |
AB2C3D13E14 |
-18.09 |
2.5 |
-8.4 |
-0.58 |
0 |
|
|
279788 |
103845191 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-52.9 |
5.32 |
-8.11 |
0.12 |
0 |
|
|
279789 |
103845193 |
1 |
OCl2N3H11C15 |
AB2C3D11E15 |
45.53 |
5.66 |
-8.83 |
-1.03 |
0 |
|
|
279790 |
103845198 |
1 |
OCl2N2H12C16 |
AB2C2D12E16 |
26.85 |
5.02 |
-8.44 |
-0.92 |
0 |
|
|
279791 |
103845200 |
1 |
SN4C13H14 |
AB4C13D14 |
86.27 |
3.47 |
-8.66 |
-0.61 |
0 |
|
|
279792 |
103845202 |
1 |
Cl2N2H12C13 |
A2B2C12D13 |
32.16 |
2.85 |
-8.68 |
-0.67 |
0 |
|
|
279793 |
103845206 |
1 |
ClFN2H12C13 |
ABC2D12E13 |
-6.92 |
3.28 |
-8.68 |
-0.7 |
0 |
|
|
279794 |
103845207 |
1 |
BrON2C14H21 |
ABC2D14E21 |
-45.64 |
3.6 |
-8.7 |
-0.14 |
0 |
|
|
279795 |
103845209 |
1 |
ClFON2C13H18 |
ABCD2E13F18 |
-91.93 |
3.23 |
-9.24 |
-0.39 |
0 |
|
|
279796 |
103845210 |
1 |
ON4C12H22 |
AB4C12D22 |
-27.86 |
6.85 |
-9.07 |
0.82 |
0 |
|
|
279797 |
103845211 |
1 |
ClFNC14H17 |
ABCD14E17 |
-3.51 |
1.93 |
-9.24 |
-0.37 |
0 |
|
|
279798 |
103845212 |
1 |
BrON2C14H23 |
ABC2D14E23 |
-40.69 |
1.46 |
-8.83 |
-0.08 |
0 |
|
|
279799 |
103845213 |
1 |
OCl2N2C13H20 |
AB2C2D13E20 |
-51.88 |
2.66 |
-8.61 |
-0.56 |
0 |
|
|
279800 |
103845215 |
1 |
N3C14H23 |
A3B14C23 |
29.53 |
2.37 |
-8.99 |
0.88 |
0 |
|
|
279801 |
103845217 |
1 |
N2C17H20 |
A2B17C20 |
50.97 |
3.94 |
-9.1 |
-0.74 |
0 |
|
|
279802 |
103845218 |
1 |
NSC14H21 |
ABC14D21 |
13.19 |
0.95 |
-8.97 |
0.1 |
0 |
|
|
279803 |
103845220 |
1 |
ClN3C15H18 |
AB3C15D18 |
48.14 |
0.97 |
-9.16 |
-0.89 |
0 |
|
|
279804 |
103845227 |
2 |
NC9H13 |
AB9C13 |
24.05 |
2.33 |
-8.88 |
0.44 |
0 |
|
|
279805 |
103845228 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-108.0 |
3.26 |
-9.1 |
0.87 |
0 |
|
|
279806 |
103845230 |
1 |
ON2C15H20 |
AB2C15D20 |
-19.42 |
4.54 |
-9.24 |
-0.22 |
0 |
|
|
279807 |
103845234 |
1 |
NSC15H21 |
ABC15D21 |
22.78 |
2.41 |
-8.5 |
-0.05 |
0 |
|
|
279808 |
103845236 |
1 |
NO2C16H23 |
AB2C16D23 |
-55.07 |
1.31 |
-8.18 |
0.17 |
0 |
|
|
279809 |
103845239 |
1 |
NOC16H23 |
ABC16D23 |
-24.66 |
0.5 |
-8.43 |
0.43 |
0 |
|
|
279810 |
103845241 |
1 |
ClNO2C16H22 |
ABC2D16E22 |
-61.48 |
2.52 |
-8.78 |
-0.32 |
0 |
|
|
279811 |
103845242 |
1 |
SN2O2C12H16 |
AB2C2D12E16 |
23.59 |
6.82 |
-9.39 |
-1.58 |
0 |
|
|
279812 |
103845245 |
1 |
NOC17H25 |
ABC17D25 |
-33.5 |
2.08 |
-8.64 |
0.47 |
0 |
|
|
279813 |
103845248 |
1 |
NO2C15H21 |
AB2C15D21 |
-57.77 |
3.17 |
-8.61 |
0.15 |
0 |
|
|
279814 |
103845251 |
1 |
NO2C16H23 |
AB2C16D23 |
-63.81 |
1.83 |
-8.2 |
0.28 |
0 |
|
|
279815 |
103845255 |
1 |
NO3C17H25 |
AB3C17D25 |
-91.79 |
2.9 |
-7.97 |
0.1 |
0 |
|
|
279816 |
103845257 |
1 |
NF2C14H17 |
AB2C14D17 |
-69.07 |
4.01 |
-9.31 |
-0.27 |
0 |
|
|
279817 |
103845260 |
2 |
N2C8H11 |
A2B8C11 |
61.59 |
2.14 |
-8.7 |
-0.32 |
0 |
|
|
279818 |
103845261 |
1 |
NSC14H21 |
ABC14D21 |
7.14 |
1.4 |
-8.79 |
0.27 |
0 |
|
|
279819 |
103845265 |
1 |
SN3C15H25 |
AB3C15D25 |
19.15 |
1.12 |
-8.37 |
0.0 |
0 |
|
|
279820 |
103845266 |
1 |
NO3C17H23 |
AB3C17D23 |
-85.27 |
1.86 |
-8.36 |
0.29 |
0 |
|
|
279821 |
103845268 |
1 |
NOC17H25 |
ABC17D25 |
-32.45 |
0.95 |
-8.5 |
0.43 |
0 |
|
|
279822 |
103845269 |
1 |
N3C17H21 |
A3B17C21 |
61.68 |
5.65 |
-9.21 |
-0.55 |
0 |
|
|
279823 |
103845270 |
1 |
NOC16H21 |
ABC16D21 |
-16.98 |
1.24 |
-8.57 |
0.27 |
0 |
|
|
279824 |
103845272 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-125.95 |
1.41 |
-9.06 |
1.01 |
0 |
|
|
279825 |
103845275 |
1 |
NSO2C17H23 |
ABC2D17E23 |
-51.82 |
3.91 |
-8.43 |
-0.26 |
0 |
|
|
279826 |
103845278 |
1 |
SN3C15H19 |
AB3C15D19 |
70.22 |
3.96 |
-9.07 |
-0.72 |
0 |
|
|
279827 |
103845279 |
1 |
N3C17H21 |
A3B17C21 |
72.22 |
3.32 |
-8.89 |
-0.5 |
0 |
|
|
279828 |
103845280 |
1 |
NC12H23 |
AB12C23 |
-25.21 |
1.29 |
-8.81 |
1.48 |
0 |
|
|
279829 |
103845281 |
1 |
ClN2O2C14H17 |
AB2C2D14E17 |
6.83 |
2.35 |
-9.18 |
-1.56 |
0 |
|
|
279830 |
103845286 |
1 |
ON2C18H26 |
AB2C18D26 |
-17.22 |
1.27 |
-8.24 |
0.35 |
0 |
|
|
279831 |
103845287 |
1 |
NO2C14H19 |
AB2C14D19 |
-71.64 |
3.13 |
-8.75 |
0.2 |
0 |
|
|
279832 |
103845288 |
1 |
BrNO2C16H22 |
ABC2D16E22 |
-47.51 |
5.42 |
-8.42 |
-0.09 |
0 |
|
|
279833 |
103845293 |
1 |
N3C14H23 |
A3B14C23 |
22.86 |
4.05 |
-8.73 |
0.99 |
0 |
|
|
279834 |
103845294 |
4 |
NC4H5 |
AB4C5 |
76.33 |
3.3 |
-9.11 |
-0.75 |
0 |
|
|
279835 |
103845296 |
2 |
NC9H13 |
AB9C13 |
19.42 |
1.94 |
-7.92 |
0.61 |
0 |
|
|
279836 |
103845297 |
1 |
FNOC15H20 |
ABCD15E20 |
-60.96 |
3.75 |
-8.8 |
0.06 |
0 |
|
|
279837 |
103845302 |
2 |
NOC8H14 |
ABC8D14 |
-118.34 |
3.91 |
-9.17 |
1.0 |
0 |
|
|
279838 |
103845303 |
1 |
NOC17H21 |
ABC17D21 |
43.63 |
2.1 |
-8.85 |
0.23 |
0 |
|
|
279839 |
103845307 |
1 |
ClNO2C16H20 |
ABC2D16E20 |
-58.28 |
1.17 |
-8.82 |
-0.15 |
0 |
|
|
279840 |
103845312 |
2 |
NC6H11 |
AB6C11 |
-5.02 |
1.89 |
-8.79 |
1.46 |
0 |
|
|
279841 |
103845313 |
1 |
N3C13H21 |
A3B13C21 |
22.59 |
4.31 |
-9.04 |
0.72 |
0 |
|
|
279842 |
103845314 |
1 |
ON3C14H23 |
AB3C14D23 |
-2.94 |
3.66 |
-8.86 |
0.45 |
0 |
|
|
279843 |
103845319 |
1 |
FN2C15H17 |
AB2C15D17 |
8.5 |
4.63 |
-9.36 |
-0.93 |
0 |
|
|
279844 |
103845323 |
1 |
NO2C17H25 |
AB2C17D25 |
-57.38 |
1.35 |
-8.12 |
0.42 |
0 |
|
|
279845 |
103845325 |
1 |
BrNO2C16H22 |
ABC2D16E22 |
-51.98 |
2.16 |
-8.53 |
-0.16 |
0 |
|
|
279846 |
103845326 |
2 |
NOC8H11 |
ABC8D11 |
-56.8 |
3.87 |
-8.95 |
-0.1 |
0 |
|
|
279847 |
103845328 |
1 |
N3C17H23 |
A3B17C23 |
40.74 |
3.62 |
-8.78 |
-0.03 |
0 |
|
|
279848 |
103845330 |
1 |
NF2C14H17 |
AB2C14D17 |
-72.75 |
1.73 |
-9.07 |
-0.39 |
0 |
|
|
279849 |
103845331 |
1 |
ClNO2C16H22 |
ABC2D16E22 |
-60.38 |
3.77 |
-8.42 |
-0.01 |
0 |