List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
278800 |
103838323 |
1 |
NO2C12H21 |
AB2C12D21 |
-109.49 |
3.09 |
-9.7 |
1.05 |
0 |
|
|
278801 |
103838339 |
1 |
SN2O2C14H30 |
AB2C2D14E30 |
-126.43 |
5.54 |
-9.19 |
0.46 |
0 |
|
|
278802 |
103838345 |
1 |
N2O2C17H32 |
A2B2C17D32 |
-127.09 |
2.82 |
-8.7 |
1.08 |
0 |
|
|
278803 |
103838376 |
1 |
NO2C17H27 |
AB2C17D27 |
-101.64 |
1.34 |
-8.72 |
0.26 |
0 |
|
|
278804 |
103838394 |
1 |
NSO2C16H19 |
ABC2D16E19 |
-38.96 |
3.12 |
-8.74 |
-0.13 |
0 |
|
|
278805 |
103838399 |
1 |
SN2C17H26 |
AB2C17D26 |
3.55 |
2.98 |
-8.14 |
0.44 |
0 |
|
|
278806 |
103838404 |
1 |
N2O2C17H32 |
A2B2C17D32 |
-126.55 |
1.59 |
-8.81 |
0.86 |
0 |
|
|
278807 |
103838414 |
1 |
NOC16H31 |
ABC16D31 |
-99.99 |
1.47 |
-8.73 |
2.56 |
0 |
|
|
278808 |
103838440 |
1 |
NC12H25 |
AB12C25 |
-25.2 |
1.58 |
-8.69 |
2.72 |
0 |
|
|
278809 |
103838516 |
1 |
ClN4O5C10H11 |
AB4C5D10E11 |
-101.76 |
4.36 |
-10.28 |
-1.91 |
0 |
|
|
278810 |
103838519 |
1 |
FN3O5C11H12 |
AB3C5D11E12 |
-150.97 |
3.53 |
-10.51 |
-1.98 |
0 |
|
|
278811 |
103838529 |
1 |
ClINOC12H13 |
ABCDE12F13 |
-12.71 |
4.41 |
-8.94 |
-1.2 |
0 |
|
|
278812 |
103838550 |
1 |
N3C15H25 |
A3B15C25 |
46.49 |
3.4 |
-8.71 |
0.86 |
0 |
|
|
278813 |
103838560 |
4 |
NC4H5 |
AB4C5 |
104.25 |
2.55 |
-8.95 |
-0.57 |
0 |
|
|
278814 |
103838567 |
1 |
ClN2C17H19 |
AB2C17D19 |
70.51 |
1.64 |
-9.03 |
-0.94 |
0 |
|
|
278815 |
103838571 |
1 |
NOF2C15H19 |
ABC2D15E19 |
-91.96 |
4.62 |
-9.03 |
-0.26 |
0 |
|
|
278816 |
103838583 |
1 |
NOC16H23 |
ABC16D23 |
4.2 |
2.33 |
-8.53 |
0.39 |
0 |
|
|
278817 |
103838599 |
1 |
NOC16H19 |
ABC16D19 |
37.07 |
1.33 |
-8.96 |
-0.22 |
0 |
|
|
278818 |
103838614 |
1 |
SN3C15H25 |
AB3C15D25 |
47.27 |
1.37 |
-8.3 |
0.03 |
0 |
|
|
278819 |
103838642 |
1 |
ON2C18H26 |
AB2C18D26 |
11.22 |
1.65 |
-8.4 |
0.25 |
0 |
|
|
278820 |
103838680 |
1 |
ClN2O2C14H17 |
AB2C2D14E17 |
42.06 |
7.3 |
-9.48 |
-1.38 |
0 |
|
|
278821 |
103838688 |
1 |
NOF3C15H18 |
ABC3D15E18 |
-150.46 |
3.79 |
-9.02 |
-0.36 |
0 |
|
|
278822 |
103838690 |
1 |
NF3C15H18 |
AB3C15D18 |
-108.11 |
1.85 |
-9.15 |
-0.57 |
0 |
|
|
278823 |
103838725 |
1 |
ON3C16H21 |
AB3C16D21 |
51.22 |
2.97 |
-8.87 |
-0.34 |
0 |
|
|
278824 |
103838737 |
1 |
NO2C18H25 |
AB2C18D25 |
-35.58 |
4.76 |
-8.16 |
0.07 |
0 |
|
|
278825 |
103838743 |
1 |
OSN3C15H23 |
ABC3D15E23 |
11.24 |
3.47 |
-9.29 |
-0.7 |
0 |
|
|
278826 |
103838754 |
1 |
NOC17H25 |
ABC17D25 |
-3.94 |
3.22 |
-8.69 |
0.37 |
0 |
|
|
278827 |
103838755 |
1 |
NO2C17H21 |
AB2C17D21 |
-0.88 |
3.0 |
-8.56 |
-0.19 |
0 |
|
|
278828 |
103838759 |
1 |
NOC17H25 |
ABC17D25 |
-0.43 |
0.43 |
-8.57 |
0.38 |
0 |
|
|
278829 |
103838778 |
1 |
F3N3C12H20 |
A3B3C12D20 |
-152.38 |
3.51 |
-9.14 |
0.81 |
0 |
|
|
278830 |
103838779 |
1 |
NO2C11H19 |
AB2C11D19 |
-73.3 |
2.78 |
-9.41 |
1.0 |
0 |
|
|
278831 |
103838787 |
1 |
BrClNOC13H17 |
ABCDE13F17 |
-42.34 |
1.34 |
-9.22 |
-0.56 |
0 |
|
|
278832 |
103838794 |
1 |
ClFON2C13H20 |
ABCD2E13F20 |
-87.99 |
1.55 |
-8.64 |
-0.44 |
0 |
|
|
278833 |
103838800 |
1 |
OSN2C17H24 |
ABC2D17E24 |
-3.16 |
2.49 |
-8.6 |
-0.35 |
0 |
|
|
278834 |
103838812 |
1 |
N2O4C15H24 |
A2B4C15D24 |
-131.86 |
4.15 |
-8.55 |
-0.05 |
0 |
|
|
278835 |
103838835 |
1 |
ON4C10H20 |
AB4C10D20 |
-24.41 |
2.45 |
-8.72 |
0.62 |
0 |
|
|
278836 |
103838856 |
1 |
BrN2O2C13H21 |
AB2C2D13E21 |
-77.5 |
4.09 |
-8.82 |
-0.2 |
0 |
|
|
278837 |
103838863 |
1 |
ON2C15H26 |
AB2C15D26 |
-50.99 |
3.23 |
-8.64 |
0.41 |
0 |
|
|
278838 |
103838892 |
1 |
ON2C14H30 |
AB2C14D30 |
-82.31 |
2.78 |
-8.52 |
2.58 |
0 |
|
|
278839 |
103838928 |
1 |
ON4C14H22 |
AB4C14D22 |
10.92 |
4.58 |
-8.56 |
-0.65 |
0 |
|
|
278840 |
103838940 |
1 |
OCl2N2C13H20 |
AB2C2D13E20 |
-52.26 |
3.51 |
-8.68 |
-0.5 |
0 |
|
|
278841 |
103838972 |
1 |
ON4C12H24 |
AB4C12D24 |
-23.37 |
0.31 |
-8.75 |
0.76 |
0 |
|
|
278842 |
103838985 |
1 |
N3O4C14H23 |
A3B4C14D23 |
-74.71 |
8.29 |
-8.66 |
-1.17 |
0 |
|
|
278843 |
103838994 |
1 |
ClN2O2C14H23 |
AB2C2D14E23 |
-83.44 |
3.27 |
-8.76 |
0.0 |
0 |
|
|
278844 |
103839000 |
2 |
BrNOC7H11 |
ABCD7E11 |
-62.45 |
2.69 |
-8.66 |
-0.58 |
0 |
|
|
278845 |
103839002 |
1 |
OF2N2C13H20 |
AB2C2D13E20 |
-125.87 |
2.54 |
-8.56 |
-0.45 |
0 |
|
|
278846 |
103839016 |
1 |
ClFON2C13H20 |
ABCD2E13F20 |
-89.78 |
2.72 |
-8.61 |
-0.54 |
0 |
|
|
278847 |
103839024 |
1 |
SO2N4C14H26 |
AB2C4D14E26 |
-79.67 |
2.89 |
-8.84 |
-0.62 |
0 |
|
|
278848 |
103839026 |
1 |
ON5C14H23 |
AB5C14D23 |
11.1 |
1.49 |
-8.86 |
-0.89 |
0 |
|
|
278849 |
103839035 |
1 |
ON2C15H32 |
AB2C15D32 |
-94.41 |
0.4 |
-8.62 |
2.69 |
0 |
|
|
278850 |
103839053 |
1 |
NO3C14H23 |
AB3C14D23 |
-149.38 |
3.01 |
-9.37 |
0.57 |
0 |
|
|
278851 |
103839059 |
1 |
ON2F3C10H15 |
AB2C3D10E15 |
-180.58 |
4.65 |
-10.04 |
0.57 |
0 |
|
|
278852 |
103839063 |
1 |
NO2C15H19 |
AB2C15D19 |
-69.29 |
3.18 |
-8.89 |
0.05 |
0 |
|
|
278853 |
103839068 |
1 |
NO2C12H21 |
AB2C12D21 |
-103.1 |
5.19 |
-9.26 |
1.01 |
0 |
|
|
278854 |
103839072 |
1 |
NO2C11H21 |
AB2C11D21 |
-112.09 |
3.14 |
-9.68 |
1.04 |
0 |
|
|
278855 |
103839084 |
1 |
NO2C12H23 |
AB2C12D23 |
-108.41 |
3.04 |
-8.56 |
2.43 |
0 |
|
|
278856 |
103839086 |
2 |
NOC6H11 |
ABC6D11 |
-114.27 |
5.09 |
-8.85 |
1.29 |
0 |
|
|
278857 |
103839124 |
2 |
NOC8H10 |
ABC8D10 |
-32.57 |
6.73 |
-9.02 |
-0.56 |
0 |
|
|
278858 |
103839138 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-75.67 |
3.23 |
-9.6 |
-0.02 |
0 |
|
|
278859 |
103839153 |
1 |
SN2O2C11H20 |
AB2C2D11E20 |
-106.41 |
0.71 |
-8.77 |
0.6 |
0 |
|
|
278860 |
103839158 |
1 |
SN2O2C12H22 |
AB2C2D12E22 |
-114.45 |
2.97 |
-8.69 |
0.65 |
0 |
|
|
278861 |
103839180 |
1 |
BrN2O2C12H15 |
AB2C2D12E15 |
-69.1 |
3.59 |
-9.3 |
-0.28 |
0 |
|
|
278862 |
103839181 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-103.16 |
6.28 |
-9.29 |
-0.49 |
0 |
|
|
278863 |
103839195 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-92.94 |
4.56 |
-9.24 |
-0.59 |
0 |
|
|
278864 |
103839198 |
1 |
BrON2C12H17 |
ABC2D12E17 |
-48.06 |
2.84 |
-9.77 |
-1.03 |
0 |
|
|
278865 |
103839204 |
2 |
NOC6H10 |
ABC6D10 |
-66.43 |
3.14 |
-9.62 |
1.08 |
0 |
|
|
278866 |
103839207 |
1 |
N2O3C11H20 |
A2B3C11D20 |
-160.83 |
4.42 |
-9.66 |
0.97 |
0 |
|
|
278867 |
103839214 |
1 |
BrNOC13H16 |
ABCD13E16 |
-31.75 |
2.08 |
-8.69 |
-0.15 |
0 |
|
|
278868 |
103839232 |
1 |
BrClNOSC11H13 |
ABCDEF11G13 |
-40.23 |
2.46 |
-8.94 |
-0.94 |
0 |
|
|
278869 |
103839233 |
1 |
NOSF4C7H11 |
ABCD4E7F11 |
-255.84 |
4.7 |
-9.14 |
0.01 |
0 |
|
|
278870 |
103839236 |
1 |
ON2S3C10H16 |
AB2C3D10E16 |
-37.09 |
4.54 |
-8.5 |
-0.88 |
0 |
|
|
278871 |
103839261 |
1 |
SN2O4C13H18 |
AB2C4D13E18 |
-107.41 |
4.38 |
-9.88 |
-0.64 |
0 |
|
|
278872 |
103839280 |
1 |
BrNO2C15H18 |
ABC2D15E18 |
-28.35 |
3.69 |
-9.27 |
-0.39 |
0 |
|
|
278873 |
103839292 |
1 |
NOF4C15H15 |
ABC4D15E15 |
-198.33 |
5.58 |
-10.15 |
-1.15 |
0 |
|
|
278874 |
103839330 |
1 |
BrNOC15H18 |
ABCD15E18 |
1.17 |
3.72 |
-9.68 |
-0.5 |
0 |