List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
284800 |
104072286 |
1 |
SO2C11H14 |
AB2C11D14 |
-53.22 |
3.06 |
-8.98 |
-0.82 |
0 |
|
|
284801 |
104072287 |
1 |
SO2C12H16 |
AB2C12D16 |
-54.74 |
5.42 |
-8.95 |
-0.77 |
0 |
|
|
284802 |
104072288 |
1 |
S2O4H12C13 |
A2B4C12D13 |
-92.65 |
3.17 |
-9.36 |
-1.23 |
0 |
|
|
284803 |
104072289 |
1 |
SN2O2H8C10 |
AB2C2D8E10 |
12.24 |
3.83 |
-9.23 |
-1.04 |
0 |
|
|
284804 |
104072290 |
1 |
SO2N3C10H11 |
AB2C3D10E11 |
8.53 |
6.43 |
-9.01 |
-1.0 |
0 |
|
|
284805 |
104072291 |
1 |
S2O4C9H12 |
A2B4C9D12 |
-124.65 |
5.43 |
-9.29 |
-0.87 |
0 |
|
|
284806 |
104072292 |
1 |
SN2O2H8C10 |
AB2C2D8E10 |
9.07 |
2.61 |
-9.44 |
-1.05 |
0 |
|
|
284807 |
104072294 |
1 |
SO3C10H14 |
AB3C10D14 |
-85.12 |
6.64 |
-8.93 |
-0.74 |
0 |
|
|
284808 |
104072296 |
1 |
ClON4C10H15 |
ABC4D10E15 |
-16.39 |
3.93 |
-8.74 |
-0.18 |
0 |
|
|
284809 |
104072298 |
1 |
ClNSO2H8C11 |
ABCD2E8F11 |
-10.51 |
3.74 |
-9.09 |
-0.97 |
0 |
|
|
284810 |
104072300 |
1 |
NSO2C12H19 |
ABC2D12E19 |
-47.94 |
6.89 |
-8.63 |
-0.64 |
0 |
|
|
284811 |
104072301 |
1 |
SO3C10H14 |
AB3C10D14 |
-94.56 |
3.81 |
-9.1 |
-0.85 |
0 |
|
|
284812 |
104072304 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-37.0 |
3.33 |
-9.09 |
-0.87 |
0 |
|
|
284813 |
104072305 |
1 |
SO3C9H10 |
AB3C9D10 |
-58.15 |
3.61 |
-9.35 |
-0.93 |
0 |
|
|
284814 |
104072308 |
1 |
ClN4C13H15 |
AB4C13D15 |
36.05 |
2.78 |
-8.88 |
-0.08 |
0 |
|
|
284815 |
104072309 |
1 |
FSO2H9C12 |
ABC2D9E12 |
-57.11 |
4.2 |
-9.02 |
-1.0 |
0 |
|
|
284816 |
104072311 |
1 |
NSO2C10H15 |
ABC2D10E15 |
-38.58 |
5.64 |
-9.02 |
-0.75 |
0 |
|
|
284817 |
104072312 |
1 |
N3H15C17 |
A3B15C17 |
95.24 |
9.23 |
-8.99 |
-0.98 |
0 |
|
|
284818 |
104072313 |
2 |
NOSC5H5 |
ABCD5E5 |
6.33 |
2.43 |
-9.32 |
-1.19 |
0 |
|
|
284819 |
104072317 |
1 |
SO4H14C15 |
AB4C14D15 |
-86.91 |
6.89 |
-8.7 |
-0.83 |
0 |
|
|
284820 |
104072318 |
1 |
BrN3H12C16 |
AB3C12D16 |
107.84 |
10.17 |
-9.06 |
-0.99 |
0 |
|
|
284821 |
104072319 |
1 |
NO2C16H19 |
AB2C16D19 |
-44.43 |
1.68 |
-8.22 |
0.22 |
0 |
|
|
284822 |
104072389 |
1 |
N2O3H12C14 |
A2B3C12D14 |
-53.13 |
1.12 |
-9.37 |
-0.87 |
0 |
|
|
284823 |
104072829 |
1 |
NSO2C17H23 |
ABC2D17E23 |
-36.56 |
3.19 |
-8.55 |
0.1 |
0 |
|
|
284824 |
104072941 |
1 |
NSO2C11H17 |
ABC2D11E17 |
-32.0 |
3.56 |
-8.56 |
-0.04 |
0 |
|
|
284825 |
104072943 |
1 |
NSO2C12H21 |
ABC2D12E21 |
-69.82 |
3.04 |
-8.4 |
0.18 |
0 |
|
|
284826 |
104072989 |
1 |
SN2O4C13H14 |
AB2C4D13E14 |
-18.42 |
3.52 |
-8.6 |
-1.73 |
0 |
|
|
284827 |
104073290 |
1 |
OSN4C12H18 |
ABC4D12E18 |
22.01 |
4.07 |
-9.02 |
-0.5 |
0 |
|
|
284828 |
104073325 |
1 |
NOSC18H25 |
ABCD18E25 |
-14.97 |
0.8 |
-8.52 |
-0.16 |
0 |
|
|
284829 |
104073370 |
1 |
OSN2C11H12 |
ABC2D11E12 |
22.17 |
3.02 |
-8.77 |
-0.36 |
0 |
|
|
284830 |
104073971 |
1 |
ClON4C9H13 |
ABC4D9E13 |
-7.51 |
1.94 |
-8.94 |
-0.18 |
0 |
|
|
284831 |
104074435 |
1 |
N2O2F3C13H13 |
A2B2C3D13E13 |
-209.51 |
2.19 |
-10.07 |
-0.91 |
0 |
|
|
284832 |
104074466 |
1 |
ON5C10H15 |
AB5C10D15 |
18.49 |
4.57 |
-10.41 |
-0.27 |
0 |
|
|
284833 |
104074665 |
1 |
FN2O2C13H15 |
AB2C2D13E15 |
-87.96 |
5.11 |
-9.43 |
-0.75 |
0 |
|
|
284834 |
104075181 |
1 |
NO3H13C16 |
AB3C13D16 |
-40.97 |
2.62 |
-9.83 |
-1.39 |
0 |
|
|
284835 |
104075227 |
1 |
ON2S2H10C16 |
AB2C2D10E16 |
68.92 |
4.46 |
-8.74 |
-1.61 |
0 |
|
|
284836 |
104075714 |
1 |
ON3C17H19 |
AB3C17D19 |
32.32 |
4.15 |
-9.17 |
-0.85 |
0 |
|
|
284837 |
104076117 |
1 |
ON3C16H23 |
AB3C16D23 |
-10.29 |
4.01 |
-8.37 |
-0.72 |
0 |
|
|
284838 |
104076118 |
1 |
ON3C16H23 |
AB3C16D23 |
-4.19 |
4.4 |
-8.61 |
-0.71 |
0 |
|
|
284839 |
104076339 |
1 |
ON2C16H18 |
AB2C16D18 |
63.93 |
6.0 |
-9.33 |
-0.7 |
0 |
|
|
284840 |
104076413 |
1 |
ON3C13H13 |
AB3C13D13 |
30.38 |
3.8 |
-9.46 |
-1.23 |
0 |
|
|
284841 |
104076416 |
1 |
ON3H13C16 |
AB3C13D16 |
59.29 |
2.38 |
-9.32 |
-1.26 |
0 |
|
|
284842 |
104076484 |
3 |
NOC5H5 |
ABC5D5 |
-41.5 |
3.5 |
-10.16 |
-1.39 |
0 |
|
|
284843 |
104076739 |
1 |
ClFNO2H11C15 |
ABCD2E11F15 |
-63.12 |
2.69 |
-9.67 |
-1.16 |
0 |
|
|
284844 |
104076740 |
1 |
ClFNO2H11C15 |
ABCD2E11F15 |
-61.52 |
4.26 |
-9.55 |
-1.03 |
0 |
|
|
284845 |
104076741 |
1 |
ClFNO2H11C15 |
ABCD2E11F15 |
-61.5 |
2.22 |
-9.6 |
-1.14 |
0 |
|
|
284846 |
104076839 |
1 |
NOSC18H19 |
ABCD18E19 |
8.31 |
4.39 |
-8.8 |
-0.65 |
0 |
|
|
284847 |
104076881 |
1 |
OSN3H11C13 |
ABC3D11E13 |
49.93 |
3.75 |
-9.31 |
-1.08 |
0 |
|
|
284848 |
104076885 |
1 |
NOSC13H17 |
ABCD13E17 |
-17.89 |
4.77 |
-8.84 |
-0.72 |
0 |
|
|
284849 |
104076930 |
1 |
NSO2C11H13 |
ABC2D11E13 |
-51.4 |
5.28 |
-8.75 |
-0.94 |
0 |