List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
172830 |
75558961 |
1 |
BrOSN3H14C16 |
ABCD3E14F16 |
48.7 |
4.18 |
-8.52 |
-1.18 |
0 |
|
|
172831 |
75558973 |
1 |
BrN3O3H16C18 |
AB3C3D16E18 |
-71.19 |
9.79 |
-9.21 |
-1.54 |
0 |
|
|
172832 |
75558974 |
1 |
BrN3O3H14C17 |
AB3C3D14E17 |
-61.91 |
10.02 |
-9.22 |
-1.56 |
0 |
|
|
172833 |
75558975 |
1 |
N3O3H17C18 |
A3B3C17D18 |
-73.05 |
8.3 |
-9.1 |
-1.41 |
0 |
|
|
172834 |
75559076 |
1 |
SO2N3H21C24 |
AB2C3D21E24 |
6.49 |
4.75 |
-8.79 |
-1.59 |
0 |
|
|
172835 |
75559077 |
1 |
SN3O3H19C23 |
AB3C3D19E23 |
-13.67 |
4.24 |
-8.71 |
-1.62 |
0 |
|
|
172836 |
75559078 |
2 |
ON2C10H10 |
AB2C10D10 |
22.8 |
4.89 |
-8.29 |
-0.43 |
0 |
|
|
172837 |
75559079 |
1 |
SN2O2H16C17 |
AB2C2D16E17 |
-28.94 |
5.89 |
-8.65 |
-1.12 |
0 |
|
|
172838 |
75559080 |
1 |
SN2O2C18H18 |
AB2C2D18E18 |
-33.45 |
3.59 |
-8.64 |
-1.01 |
0 |
|
|
172839 |
75559081 |
1 |
SN2O2H16C18 |
AB2C2D16E18 |
-0.37 |
3.82 |
-8.69 |
-1.06 |
0 |
|
|
172840 |
75559188 |
1 |
SN2O2H14C16 |
AB2C2D14E16 |
-20.55 |
6.53 |
-8.59 |
-1.13 |
0 |
|
|
172841 |
75559189 |
1 |
ON2S2H12C15 |
AB2C2D12E15 |
47.12 |
4.48 |
-8.69 |
-1.49 |
0 |
|
|
172842 |
75559190 |
1 |
OSN3H19C22 |
ABC3D19E22 |
69.6 |
2.65 |
-8.51 |
-0.94 |
0 |
|
|
172843 |
75559201 |
1 |
N3O3H19C22 |
A3B3C19D22 |
22.69 |
8.31 |
-8.25 |
-0.93 |
0 |
|
|
172844 |
75559202 |
1 |
N4O5H18C22 |
A4B5C18D22 |
18.94 |
9.17 |
-8.44 |
-1.6 |
0 |
|
|
172845 |
75559203 |
1 |
ClO2N3H18C20 |
AB2C3D18E20 |
18.11 |
4.93 |
-8.41 |
-0.46 |
0 |
|
|
172846 |
75559204 |
1 |
ClN2H15C20 |
AB2C15D20 |
104.59 |
3.42 |
-8.68 |
-0.77 |
0 |
|
|
172847 |
75559205 |
1 |
BrN2H15C20 |
AB2C15D20 |
116.61 |
3.46 |
-8.7 |
-0.79 |
0 |
|
|
172848 |
75559418 |
1 |
N3C15H19 |
A3B15C19 |
60.62 |
4.89 |
-7.79 |
0.25 |
0 |
|
|
172849 |
75560005 |
1 |
IO2N3H18C20 |
AB2C3D18E20 |
47.11 |
5.1 |
-8.41 |
-0.96 |
0 |
|
|
172850 |
75560391 |
1 |
F3O3N4H17C20 |
A3B3C4D17E20 |
-110.46 |
12.18 |
-8.68 |
-1.42 |
0 |
|
|
172851 |
75560709 |
1 |
ClO2N3C23H28 |
AB2C3D23E28 |
-41.84 |
8.27 |
-7.97 |
-0.32 |
0 |
|
|
172852 |
75560893 |
1 |
SO2N4C30H38 |
AB2C4D30E38 |
-38.76 |
5.0 |
-8.04 |
-0.56 |
0 |
|
|
172853 |
75560968 |
1 |
ClOSN3C24H26 |
ABCD3E24F26 |
9.67 |
4.93 |
-7.96 |
-0.92 |
0 |
|
|
172854 |
75560969 |
1 |
OSCl2N3C24H25 |
ABC2D3E24F25 |
2.85 |
5.12 |
-7.97 |
-1.02 |
0 |
|
|
172855 |
75560970 |
1 |
FON3C24H26 |
ABC3D24E26 |
-32.08 |
8.75 |
-8.24 |
-0.94 |
0 |
|
|
172856 |
75560971 |
1 |
OCl2N3C24H25 |
AB2C3D24E25 |
-2.39 |
8.97 |
-8.29 |
-1.07 |
0 |
|
|
172857 |
75560972 |
1 |
N3O5C26H27 |
A3B5C26D27 |
-156.55 |
10.35 |
-8.34 |
-1.18 |
0 |
|
|
172858 |
75560973 |
1 |
N3O3C35H41 |
A3B3C35D41 |
-123.23 |
9.44 |
-8.3 |
-1.1 |
0 |
|
|
172859 |
75561074 |
1 |
ClSO2N3C25H28 |
ABC2D3E25F28 |
-29.5 |
2.62 |
-8.06 |
-0.79 |
0 |
|
|
172860 |
75561092 |
1 |
OCl2N3C23H23 |
AB2C3D23E23 |
5.22 |
9.86 |
-8.5 |
-1.15 |
0 |
|
|
172861 |
75561175 |
1 |
ClO2N3C21H26 |
AB2C3D21E26 |
-50.06 |
7.26 |
-8.4 |
-0.89 |
0 |
|
|
172862 |
75561554 |
1 |
BrFSO2N3C25H25 |
ABCD2E3F25G25 |
-80.35 |
14.56 |
-8.67 |
-1.47 |
0 |
|
|
172863 |
75561654 |
1 |
ClSN3O3C25H26 |
ABC3D3E25F26 |
-75.86 |
13.89 |
-8.52 |
-1.25 |
0 |
|
|
172864 |
75561655 |
1 |
SN3O3C26H31 |
AB3C3D26E31 |
-58.5 |
1.44 |
-7.91 |
-0.7 |
0 |
|
|
172865 |
75561948 |
3 |
NC7H9 |
AB7C9 |
51.24 |
3.87 |
-7.54 |
0.07 |
0 |
|
|
172866 |
75561988 |
1 |
Br2O2N3C22H25 |
A2B2C3D22E25 |
-22.71 |
3.67 |
-7.77 |
-0.93 |
0 |
|
|
172867 |
75561989 |
1 |
SN3O3C32H33 |
AB3C3D32E33 |
-46.63 |
11.09 |
-8.11 |
-1.02 |
0 |
|
|
172868 |
75562176 |
1 |
OSN3C22H31 |
ABC3D22E31 |
-29.75 |
3.37 |
-7.95 |
-0.44 |
0 |
|
|
172869 |
75562298 |
1 |
BrO2N3C24H30 |
AB2C3D24E30 |
-31.36 |
5.75 |
-7.5 |
-0.55 |
0 |
|
|
172870 |
75562645 |
1 |
ClSO2N3C27H32 |
ABC2D3E27F32 |
-43.86 |
7.27 |
-8.21 |
-0.94 |
0 |
|
|
172871 |
75562682 |
1 |
OSCl2N3C24H25 |
ABC2D3E24F25 |
2.51 |
5.59 |
-8.1 |
-0.89 |
0 |
|
|
172872 |
75563149 |
1 |
ClN3O4C26H28 |
AB3C4D26E28 |
-143.89 |
14.51 |
-8.55 |
-1.14 |
0 |
|
|
172873 |
75563192 |
1 |
SO2N3C26H31 |
AB2C3D26E31 |
-32.14 |
9.07 |
-7.9 |
-0.6 |
0 |
|
|
172874 |
75563551 |
1 |
SO2N4C30H38 |
AB2C4D30E38 |
-30.99 |
6.89 |
-7.83 |
-0.8 |
0 |
|
|
172875 |
75564137 |
1 |
ClSO2N3C28H32 |
ABC2D3E28F32 |
-67.82 |
9.46 |
-8.5 |
-1.42 |
0 |
|
|
172876 |
75564400 |
1 |
FON4C27H31 |
ABC4D27E31 |
-9.16 |
4.53 |
-7.87 |
-0.78 |
0 |
|
|
172877 |
75564744 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-22.58 |
6.82 |
-7.68 |
-0.63 |
0 |
|
|
172878 |
75564745 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-22.09 |
4.83 |
-7.61 |
-0.67 |
0 |
|
|
172879 |
75564746 |
1 |
N3O3C26H35 |
A3B3C26D35 |
-81.94 |
6.08 |
-7.48 |
0.04 |
0 |