List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
196845 |
78885661 |
1 |
O2N4C25H32 |
A2B4C25D32 |
-2.6 |
4.5 |
-8.3 |
0.14 |
0 |
|
|
196846 |
78885662 |
4 |
OC3H5 |
AB3C5 |
-201.7 |
1.48 |
-9.79 |
0.59 |
0 |
|
|
196847 |
78885806 |
1 |
BrNO3C17H20 |
ABC3D17E20 |
-65.74 |
1.45 |
-8.14 |
-0.14 |
0 |
|
|
196848 |
78885807 |
1 |
NO3C18H19 |
AB3C18D19 |
-44.91 |
1.26 |
-8.3 |
-0.21 |
0 |
|
|
196849 |
78885808 |
1 |
ClNO3C17H20 |
ABC3D17E20 |
-79.58 |
2.04 |
-8.28 |
-0.22 |
0 |
|
|
196850 |
78885809 |
1 |
ON3C18H19 |
AB3C18D19 |
43.96 |
3.12 |
-8.32 |
-0.71 |
0 |
|
|
196851 |
78886402 |
1 |
SO3N4H20C21 |
AB3C4D20E21 |
-66.85 |
8.65 |
-8.33 |
-0.81 |
0 |
|
|
196852 |
78886615 |
1 |
O4N6H12C15 |
A4B6C12D15 |
37.22 |
4.36 |
-9.18 |
-2.06 |
0 |
|
|
196853 |
78886831 |
1 |
FO2N3C14H14 |
AB2C3D14E14 |
-82.05 |
2.79 |
-8.77 |
-0.95 |
0 |
|
|
196854 |
78888368 |
1 |
SO5C13H24 |
AB5C13D24 |
-250.84 |
8.66 |
-9.61 |
0.63 |
0 |
|
|
196855 |
78888369 |
1 |
O4C13H22 |
A4B13C22 |
-195.69 |
4.24 |
-9.76 |
0.35 |
0 |
|
|
196856 |
78888370 |
1 |
BrNO3C8H10 |
ABC3D8E10 |
-99.3 |
2.58 |
-9.71 |
-0.98 |
0 |
|
|
196857 |
78888371 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-26.32 |
3.99 |
-9.13 |
-0.98 |
0 |
|
|
196858 |
78888372 |
1 |
ClNO3C16H22 |
ABC3D16E22 |
-138.85 |
2.71 |
-9.12 |
-0.28 |
0 |
|
|
196859 |
78888385 |
1 |
BrO2N3H12C17 |
AB2C3D12E17 |
21.31 |
2.9 |
-9.34 |
-1.14 |
0 |
|
|
196860 |
78888725 |
1 |
FO2N6C21H23 |
AB2C6D21E23 |
-26.3 |
3.88 |
-9.93 |
-0.7 |
0 |
|
|
196861 |
78888726 |
1 |
SO3N4C21H22 |
AB3C4D21E22 |
-42.31 |
2.15 |
-9.19 |
-1.3 |
0 |
|
|
196862 |
78888727 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-89.07 |
2.83 |
-9.43 |
-0.81 |
0 |
|
|
196863 |
78888728 |
1 |
ON3C19H31 |
AB3C19D31 |
-50.22 |
4.14 |
-8.58 |
0.39 |
0 |
|
|
196864 |
78888991 |
1 |
FSO2N4H17C21 |
ABC2D4E17F21 |
-0.47 |
8.99 |
-8.51 |
-0.89 |
0 |
|
|
196865 |
78889142 |
1 |
N2O2H18C19 |
A2B2C18D19 |
-1.47 |
5.36 |
-8.78 |
-1.13 |
0 |
|
|
196866 |
78889143 |
2 |
NOH8C9 |
ABC8D9 |
7.8 |
6.38 |
-9.03 |
-1.1 |
0 |
|
|
196867 |
78889144 |
1 |
ClN2O2H15C18 |
AB2C2D15E18 |
-0.55 |
4.17 |
-9.18 |
-1.0 |
0 |
|
|
196868 |
78889145 |
1 |
N2O3C20H20 |
A2B3C20D20 |
-37.43 |
3.49 |
-8.43 |
-1.16 |
0 |
|
|
196869 |
78889146 |
1 |
FO3H17C18 |
AB3C17D18 |
-107.54 |
5.34 |
-8.89 |
-0.63 |
0 |
|
|
196870 |
78889147 |
1 |
ClFN2O2H14C18 |
ABC2D2E14F18 |
-46.7 |
6.32 |
-9.22 |
-1.28 |
0 |
|
|
196871 |
78889148 |
1 |
O3C14H22 |
A3B14C22 |
-145.65 |
0.58 |
-9.52 |
0.54 |
0 |
|
|
196872 |
78889149 |
3 |
OC5H8 |
AB5C8 |
-146.4 |
2.49 |
-9.5 |
0.51 |
0 |
|
|
196873 |
78889150 |
1 |
NO3H17C20 |
AB3C17D20 |
-36.18 |
3.51 |
-9.27 |
-0.68 |
0 |
|
|
196874 |
78889151 |
1 |
BrO4H13C14 |
AB4C13D14 |
-100.71 |
1.68 |
-8.62 |
-0.82 |
0 |
|
|
196875 |
78889152 |
1 |
O2N4H18C19 |
A2B4C18D19 |
28.7 |
3.87 |
-9.32 |
-0.87 |
0 |
|
|
196876 |
78889153 |
1 |
NO3C20H23 |
AB3C20D23 |
-95.3 |
1.8 |
-8.93 |
-0.25 |
0 |
|
|
196877 |
78889154 |
1 |
ClO2N4H21C22 |
AB2C4D21E22 |
0.72 |
5.72 |
-8.77 |
-0.85 |
0 |
|
|
196878 |
78889155 |
1 |
SN2O4C23H30 |
AB2C4D23E30 |
-148.16 |
1.62 |
-8.8 |
-0.21 |
0 |
|
|
196879 |
78889156 |
1 |
SN2O4C18H20 |
AB2C4D18E20 |
-117.45 |
4.69 |
-8.77 |
-0.26 |
0 |
|
|
196880 |
78889157 |
2 |
NO2C12H12 |
AB2C12D12 |
-83.43 |
5.97 |
-8.89 |
-0.61 |
0 |
|
|
196881 |
78889158 |
1 |
SN3O3C22H23 |
AB3C3D22E23 |
-58.69 |
6.82 |
-8.68 |
-0.64 |
0 |
|
|
196882 |
78889159 |
1 |
SO3N4H20C21 |
AB3C4D20E21 |
-35.7 |
7.9 |
-8.5 |
-0.76 |
0 |
|
|
196883 |
78889281 |
1 |
SF2O2N3C17H19 |
AB2C2D3E17F19 |
-153.5 |
4.22 |
-8.88 |
-1.15 |
0 |
|
|
196884 |
78889514 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-23.94 |
7.39 |
-8.56 |
-0.76 |
0 |
|
|
196885 |
78889515 |
1 |
BrClON4H12C16 |
ABCD4E12F16 |
54.33 |
5.5 |
-9.49 |
-1.15 |
0 |
|
|
196886 |
78889919 |
1 |
SF3N3O3H14C17 |
AB3C3D3E14F17 |
-178.96 |
8.04 |
-9.1 |
-1.1 |
0 |
|
|
196887 |
78889954 |
1 |
SN3O4C19H19 |
AB3C4D19E19 |
-67.63 |
6.09 |
-9.27 |
-1.22 |
0 |
|
|
196888 |
78890505 |
2 |
ON2C12H15 |
AB2C12D15 |
-42.38 |
4.7 |
-9.01 |
-0.12 |
0 |
|
|
196889 |
78890679 |
1 |
O2F3N3H20C22 |
A2B3C3D20E22 |
-165.43 |
6.67 |
-9.26 |
-1.59 |
0 |
|
|
196890 |
78891276 |
1 |
BrNO3H14C17 |
ABC3D14E17 |
-44.21 |
7.44 |
-8.96 |
-1.0 |
0 |
|
|
196891 |
78891277 |
1 |
BrClON4H14C17 |
ABCD4E14F17 |
45.88 |
8.41 |
-8.89 |
-1.19 |
0 |
|
|
196892 |
78891513 |
1 |
ClFSO2N3H15C19 |
ABCD2E3F15G19 |
-66.46 |
4.89 |
-8.7 |
-1.44 |
0 |
|
|
196893 |
78891746 |
1 |
ClO3N4H19C20 |
AB3C4D19E20 |
-28.5 |
5.02 |
-9.44 |
-0.97 |
0 |
|
|
196894 |
78891884 |
1 |
O3N4H22C23 |
A3B4C22D23 |
-25.33 |
7.78 |
-8.44 |
-0.94 |
0 |