List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
22857 |
599218 |
1 |
O2F3C13H15 |
A2B3C13D15 |
-247.9 |
4.72 |
-10.66 |
-1.12 |
0 |
|
|
22858 |
599219 |
1 |
O2F3C13H15 |
A2B3C13D15 |
-247.33 |
3.16 |
-10.59 |
-1.28 |
0 |
|
|
22859 |
599261 |
1 |
OSiC15H34 |
ABC15D34 |
-157.66 |
1.59 |
-8.68 |
1.39 |
0 |
|
|
22860 |
599262 |
1 |
SiO2C12H26 |
AB2C12D26 |
-178.85 |
3.29 |
-8.93 |
0.53 |
0 |
|
|
22861 |
599264 |
1 |
N2O5H10C12 |
A2B5C10D12 |
-177.19 |
10.32 |
-10.72 |
-2.0 |
0 |
|
|
22862 |
599266 |
1 |
OCl2N4H8C10 |
AB2C4D8E10 |
25.82 |
5.37 |
-9.35 |
-1.1 |
0 |
|
|
22863 |
599271 |
1 |
O2F3C23H35 |
A2B3C23D35 |
-292.89 |
1.39 |
-10.67 |
-1.12 |
0 |
|
|
22864 |
599272 |
1 |
O2F3C25H39 |
A2B3C25D39 |
-302.08 |
1.44 |
-10.59 |
-1.12 |
0 |
|
|
22865 |
599276 |
1 |
O2F3C14H17 |
A2B3C14D17 |
-247.23 |
4.63 |
-10.57 |
-1.09 |
0 |
|
|
22866 |
599293 |
1 |
OSiC12H28 |
ABC12D28 |
-148.79 |
1.84 |
-9.02 |
1.35 |
0 |
|
|
22867 |
599302 |
1 |
OCl2N3H15C19 |
AB2C3D15E19 |
23.53 |
3.42 |
-8.5 |
-1.12 |
0 |
|
|
22868 |
599303 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-90.29 |
7.61 |
-9.4 |
-1.5 |
0 |
|
|
22869 |
599304 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-104.15 |
3.51 |
-8.94 |
-0.98 |
0 |
|
|
22870 |
599315 |
1 |
NO4H13C18 |
AB4C13D18 |
-98.46 |
7.53 |
-9.15 |
-1.91 |
0 |
|
|
22871 |
599317 |
1 |
NF2O3H9C16 |
AB2C3D9E16 |
-147.04 |
6.43 |
-9.1 |
-1.85 |
0 |
|
|
22872 |
599318 |
1 |
N2O3H14C20 |
A2B3C14D20 |
-39.78 |
7.4 |
-8.84 |
-1.91 |
0 |
|
|
22873 |
599346 |
2 |
C7H10 |
A7B10 |
6.02 |
1.14 |
-10.14 |
1.87 |
0 |
|
|
22874 |
599347 |
1 |
ClN2O3H11C16 |
AB2C3D11E16 |
-37.17 |
2.29 |
-9.24 |
-1.73 |
0 |
|
|
22875 |
599348 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-78.81 |
1.89 |
-8.53 |
-0.4 |
0 |
|
|
22876 |
599349 |
1 |
NF3O4H10C16 |
AB3C4D10E16 |
-186.8 |
6.11 |
-10.57 |
-1.84 |
0 |
|
|
22877 |
599350 |
1 |
N3O4H19C20 |
A3B4C19D20 |
-75.71 |
4.55 |
-8.45 |
-1.02 |
0 |
|
|
22878 |
599353 |
1 |
BrO2H9C11 |
AB2C9D11 |
-48.6 |
4.73 |
-9.59 |
-0.85 |
0 |
|
|
22879 |
599354 |
1 |
ClO2F3H10C15 |
AB2C3D10E15 |
-206.8 |
2.51 |
-9.7 |
-1.42 |
0 |
|
|
22880 |
599361 |
1 |
NC12H15 |
AB12C15 |
30.4 |
1.37 |
-8.7 |
0.19 |
0 |
|
|
22881 |
599363 |
1 |
N5C17H17 |
A5B17C17 |
78.38 |
1.2 |
-8.32 |
-0.5 |
0 |
|
|
22882 |
599386 |
1 |
O2F3C12H13 |
A2B3C12D13 |
-237.22 |
4.62 |
-10.57 |
-1.08 |
0 |
|
|
22883 |
599424 |
1 |
ClO2F3H8C14 |
AB2C3D8E14 |
-196.25 |
2.43 |
-9.55 |
-1.54 |
0 |
|
|
22884 |
599431 |
1 |
O3F6H8C16 |
A3B6C8D16 |
-388.09 |
0.46 |
-10.93 |
-1.54 |
0 |
|
|
22885 |
599438 |
1 |
O2F3H9C11 |
A2B3C9D11 |
-202.46 |
4.76 |
-10.59 |
-1.16 |
0 |
|
|
22886 |
599442 |
1 |
BrNF3O4H9C16 |
ABC3D4E9F16 |
-184.04 |
6.14 |
-10.56 |
-2.21 |
0 |
|
|
22887 |
599450 |
1 |
NF3O3H10C16 |
AB3C3D10E16 |
-225.06 |
7.32 |
-9.53 |
-1.42 |
0 |
|
|
22888 |
599452 |
1 |
NF3O3H12C16 |
AB3C3D12E16 |
-238.74 |
0.9 |
-9.51 |
-1.4 |
0 |
|
|
22889 |
599453 |
1 |
NF3O3H14C17 |
AB3C3D14E17 |
-246.89 |
0.95 |
-9.48 |
-1.4 |
0 |
|
|
22890 |
599454 |
1 |
ON3F6H9C14 |
AB3C6D9E14 |
-283.43 |
3.8 |
-9.73 |
-1.15 |
0 |
|
|
22891 |
599455 |
1 |
ON3F6H9C14 |
AB3C6D9E14 |
-284.02 |
1.8 |
-9.75 |
-1.15 |
0 |
|
|
22892 |
599459 |
1 |
ClON3F6H8C14 |
ABC3D6E8F14 |
-292.11 |
2.26 |
-9.75 |
-1.44 |
0 |
|
|
22893 |
599472 |
1 |
ClNF3O4H9C16 |
ABC3D4E9F16 |
-195.6 |
5.02 |
-10.74 |
-2.08 |
0 |
|
|
22894 |
599537 |
1 |
OCl2N2H14C19 |
AB2C2D14E19 |
46.49 |
3.54 |
-8.7 |
-1.04 |
0 |
|
|
22895 |
599580 |
1 |
NOBr2Cl2H7C13 |
ABC2D2E7F13 |
-7.81 |
2.94 |
-9.22 |
-1.27 |
0 |
|
|
22896 |
599581 |
1 |
OCl2F3H7C14 |
AB2C3D7E14 |
-161.02 |
2.74 |
-10.2 |
-1.45 |
0 |
|
|
22897 |
599590 |
1 |
NCl2O2H13C20 |
AB2C2D13E20 |
4.96 |
1.91 |
-8.99 |
-1.35 |
0 |
|
|
22898 |
599593 |
1 |
O3Cl4H6C14 |
A3B4C6D14 |
-82.96 |
3.41 |
-9.81 |
-1.69 |
0 |
|
|
22899 |
599601 |
1 |
BrNO2Cl3H11C20 |
ABC2D3E11F20 |
-23.63 |
2.21 |
-9.26 |
-1.25 |
0 |
|
|
22900 |
599603 |
1 |
SCl2N2O2H10C15 |
AB2C2D2E10F15 |
-17.19 |
2.94 |
-8.67 |
-1.24 |
0 |
|
|
22901 |
599627 |
1 |
BrNOH4C5 |
ABCD4E5 |
-1.62 |
0.95 |
-9.52 |
-0.72 |
0 |
|
|
22902 |
599635 |
1 |
Cl3H7C8 |
A3B7C8 |
-15.59 |
2.03 |
-9.56 |
-0.72 |
0 |
|
|
22903 |
599639 |
1 |
NOSCl2F3H10C20 |
ABCD2E3F10G20 |
-132.69 |
5.83 |
-8.72 |
-1.13 |
0 |
|
|
22904 |
599805 |
1 |
ON2C10H10 |
AB2C10D10 |
-11.75 |
7.14 |
-9.02 |
-0.6 |
0 |
|
|
22905 |
599806 |
1 |
ON5C13H17 |
AB5C13D17 |
13.94 |
7.11 |
-8.42 |
-0.22 |
0 |
|
|
22906 |
599807 |
2 |
ClNOC5H5 |
ABCD5E5 |
-41.88 |
4.49 |
-9.32 |
-0.67 |
0 |