List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
265150 |
103511767 |
1 |
O2N3C16H17 |
A2B3C16D17 |
4.19 |
1.77 |
-8.7 |
-0.67 |
0 |
|
|
265151 |
103511869 |
1 |
O2N5C10H17 |
A2B5C10D17 |
-26.05 |
1.8 |
-9.14 |
-0.34 |
0 |
|
|
265152 |
103512013 |
1 |
ON5C8H15 |
AB5C8D15 |
24.58 |
3.95 |
-9.4 |
0.06 |
0 |
|
|
265153 |
103512217 |
1 |
ClON3C10H14 |
ABC3D10E14 |
-24.1 |
3.57 |
-9.7 |
-0.24 |
0 |
|
|
265154 |
103512252 |
1 |
ON4C12H22 |
AB4C12D22 |
-29.77 |
4.63 |
-9.27 |
0.11 |
0 |
|
|
265155 |
103512270 |
1 |
ON4C11H20 |
AB4C11D20 |
-33.27 |
3.87 |
-9.56 |
-0.13 |
0 |
|
|
265156 |
103512271 |
1 |
O2N4C11H18 |
A2B4C11D18 |
-55.98 |
2.81 |
-9.47 |
-0.24 |
0 |
|
|
265157 |
103512276 |
1 |
ON4C14H18 |
AB4C14D18 |
4.28 |
2.95 |
-8.9 |
-0.47 |
0 |
|
|
265158 |
103512346 |
1 |
ON4C13H18 |
AB4C13D18 |
36.43 |
4.28 |
-8.99 |
-0.61 |
0 |
|
|
265159 |
103512459 |
1 |
O2N5C11H15 |
A2B5C11D15 |
-5.89 |
5.94 |
-8.96 |
-0.53 |
0 |
|
|
265160 |
103512506 |
1 |
SN2O2F3C8H17 |
AB2C2D3E8F17 |
-263.3 |
7.42 |
-9.34 |
0.4 |
0 |
|
|
265161 |
103512617 |
1 |
ON2C13H20 |
AB2C13D20 |
-45.69 |
3.25 |
-9.18 |
0.08 |
0 |
|
|
265162 |
103512621 |
1 |
ON2C16H20 |
AB2C16D20 |
-18.83 |
3.79 |
-8.79 |
-0.43 |
0 |
|
|
265163 |
103512712 |
1 |
ON2F5C11H11 |
AB2C5D11E11 |
-243.76 |
5.46 |
-9.49 |
-1.39 |
0 |
|
|
265164 |
103512718 |
2 |
NOC6H12 |
ABC6D12 |
-119.97 |
3.83 |
-9.28 |
1.14 |
0 |
|
|
265165 |
103512757 |
1 |
ON2C12H26 |
AB2C12D26 |
-87.92 |
3.44 |
-9.23 |
1.37 |
0 |
|
|
265166 |
103512768 |
1 |
ON2C13H20 |
AB2C13D20 |
-42.7 |
4.11 |
-9.16 |
0.05 |
0 |
|
|
265167 |
103512810 |
2 |
NOC6H10 |
ABC6D10 |
-87.54 |
3.5 |
-8.81 |
0.46 |
0 |
|
|
265168 |
103512818 |
1 |
ON4C9H16 |
AB4C9D16 |
-9.43 |
5.41 |
-9.0 |
0.16 |
0 |
|
|
265169 |
103512839 |
1 |
ON3C12H19 |
AB3C12D19 |
-36.99 |
3.71 |
-8.59 |
0.42 |
0 |
|
|
265170 |
103512855 |
1 |
OF3N3C7H14 |
AB3C3D7E14 |
-219.28 |
5.3 |
-9.35 |
0.77 |
0 |
|
|
265171 |
103512856 |
1 |
ON3C15H19 |
AB3C15D19 |
-11.57 |
4.39 |
-8.34 |
-0.38 |
0 |
|
|
265172 |
103512862 |
1 |
F2O2H10C11 |
A2B2C10D11 |
-170.45 |
4.85 |
-9.87 |
-0.39 |
0 |
|
|
265173 |
103512866 |
1 |
NF2C13H17 |
AB2C13D17 |
-95.55 |
2.22 |
-8.95 |
0.09 |
0 |
|
|
265174 |
103512877 |
2 |
FNOC6H11 |
ABCD6E11 |
-232.31 |
2.81 |
-9.6 |
0.82 |
0 |
|
|
265175 |
103512879 |
1 |
NF2O3C12H21 |
AB2C3D12E21 |
-278.79 |
3.36 |
-9.69 |
0.74 |
0 |
|
|
265176 |
103512882 |
1 |
F2N2O2C15H28 |
A2B2C2D15E28 |
-243.2 |
2.75 |
-9.21 |
0.85 |
0 |
|
|
265177 |
103512883 |
2 |
NOH3C4 |
ABC3D4 |
-28.74 |
4.46 |
-10.28 |
-0.85 |
0 |
|
|
265178 |
103512884 |
1 |
NO3C11H11 |
AB3C11D11 |
-89.82 |
1.62 |
-8.97 |
-0.68 |
0 |
|
|
265179 |
103512885 |
1 |
NO4C12H13 |
AB4C12D13 |
-121.3 |
5.0 |
-8.74 |
-0.9 |
0 |
|
|
265180 |
103512888 |
1 |
NO2C14H19 |
AB2C14D19 |
-106.74 |
3.66 |
-10.52 |
-0.32 |
0 |
|
|
265181 |
103512889 |
1 |
NO3C11H11 |
AB3C11D11 |
-83.73 |
3.4 |
-9.27 |
-1.04 |
0 |
|
|
265182 |
103512891 |
1 |
NO3H7C10 |
AB3C7D10 |
-70.16 |
1.99 |
-9.13 |
-0.74 |
0 |
|
|
265183 |
103512892 |
1 |
INSH2O2C6 |
ABCD2E2F6 |
-8.44 |
2.86 |
-9.83 |
-1.48 |
0 |
|
|
265184 |
103512894 |
1 |
ClNO2H6C9 |
ABC2D6E9 |
-51.0 |
3.21 |
-9.89 |
-1.23 |
0 |
|
|
265185 |
103512925 |
1 |
O2N3H5C10 |
A2B3C5D10 |
12.11 |
2.91 |
-10.29 |
-1.56 |
0 |
|
|
265186 |
103512931 |
1 |
NO2C9H11 |
AB2C9D11 |
-68.09 |
3.23 |
-10.97 |
-0.39 |
0 |
|
|
265187 |
103512933 |
1 |
NO2H3F4C9 |
AB2C3D4E9 |
-236.79 |
4.41 |
-10.94 |
-1.63 |
0 |
|
|
265188 |
103512955 |
1 |
NO3C8H11 |
AB3C8D11 |
-122.28 |
3.76 |
-9.98 |
-0.36 |
0 |
|
|
265189 |
103512999 |
1 |
O2N3C9H11 |
A2B3C9D11 |
-34.52 |
1.64 |
-9.72 |
-1.04 |
0 |
|
|
265190 |
103513016 |
1 |
FNO2H6C9 |
ABC2D6E9 |
-87.94 |
2.92 |
-9.93 |
-1.14 |
0 |
|
|
265191 |
103513080 |
1 |
ClN2O2H3C7 |
AB2C2D3E7 |
-25.96 |
1.45 |
-10.26 |
-1.53 |
0 |
|
|
265192 |
103513084 |
2 |
OH2N2C4 |
AB2C2D4 |
22.14 |
3.37 |
-9.99 |
-1.62 |
0 |
|
|
265193 |
103513201 |
1 |
F2N3O3C7H7 |
A2B3C3D7E7 |
-176.76 |
3.96 |
-9.49 |
-0.54 |
0 |
|
|
265194 |
103513225 |
1 |
NO3F5H6C10 |
AB3C5D6E10 |
-357.82 |
5.32 |
-10.25 |
-1.6 |
0 |
|
|
265195 |
103513296 |
1 |
ClNF2O3H6C9 |
ABC2D3E6F9 |
-207.93 |
3.48 |
-9.96 |
-1.41 |
0 |
|
|
265196 |
103513368 |
1 |
SF2N2O3C8H8 |
AB2C2D3E8F8 |
-193.69 |
6.51 |
-10.35 |
-1.45 |
0 |
|
|
265197 |
103513373 |
1 |
NO3F5C6H6 |
AB3C5D6E6 |
-378.68 |
5.77 |
-10.69 |
-0.61 |
0 |
|
|
265198 |
103513374 |
1 |
NF2O3C8H13 |
AB2C3D8E13 |
-244.44 |
4.34 |
-10.38 |
-0.21 |
0 |
|
|
265199 |
103513491 |
1 |
NF2O3C8H11 |
AB2C3D8E11 |
-234.38 |
4.54 |
-10.45 |
-0.41 |
0 |