List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
315766 |
126628720 |
1 |
O2N3H21C24 |
A2B3C21D24 |
29.06 |
3.84 |
-8.21 |
-0.55 |
0 |
|
|
315767 |
126628721 |
1 |
O2N3H21C24 |
A2B3C21D24 |
28.19 |
5.02 |
-8.35 |
-0.59 |
0 |
|
|
315768 |
126628723 |
1 |
O2N4H20C23 |
A2B4C20D23 |
40.76 |
7.26 |
-8.39 |
-0.83 |
0 |
|
|
315771 |
126628729 |
1 |
N5O7H39C45 |
A5B7C39D45 |
-105.47 |
5.81 |
-8.69 |
-1.16 |
0 |
|
|
315772 |
126628734 |
2 |
NOC7H7 |
ABC7D7 |
-42.23 |
1.18 |
-8.18 |
-0.08 |
0 |
|
|
315773 |
126628736 |
2 |
NO2H16C24 |
AB2C16D24 |
6.26 |
2.01 |
-8.29 |
-1.21 |
0 |
|
|
315774 |
126628738 |
2 |
N2O10H27C42 |
A2B10C27D42 |
-538.2 |
4.59 |
-8.15 |
-2.26 |
0 |
|
|
315775 |
126628741 |
1 |
NC14H15 |
AB14C15 |
44.95 |
1.83 |
-9.1 |
-0.63 |
0 |
|
|
315776 |
126628746 |
1 |
C5S5H8 |
A5B5C8 |
73.25 |
3.43 |
-8.76 |
-1.64 |
0 |
|
|
315777 |
126628754 |
2 |
NOC7H12 |
ABC7D12 |
-59.39 |
2.95 |
-7.8 |
0.48 |
0 |
|
|
315778 |
126628756 |
1 |
N2C13H20 |
A2B13C20 |
37.57 |
1.76 |
-7.7 |
0.51 |
0 |
|
|
315779 |
126628757 |
2 |
NO2C9H16 |
AB2C9D16 |
-141.09 |
1.13 |
-8.01 |
0.36 |
0 |
|
|
315780 |
126628762 |
2 |
N2C13H20 |
A2B13C20 |
26.98 |
1.41 |
-7.91 |
0.6 |
0 |
|
|
315781 |
126628765 |
1 |
N5O5C32H37 |
A5B5C32D37 |
-144.69 |
5.41 |
-8.6 |
-0.45 |
0 |
|
|
315782 |
126628766 |
1 |
NPC8H12 |
ABC8D12 |
21.59 |
2.03 |
-8.84 |
0.42 |
0 |
|
|
315785 |
126628772 |
1 |
N5O6C31H43 |
A5B6C31D43 |
17.8 |
34.21 |
-4.93 |
-3.59 |
0 |
|
|
315786 |
126628774 |
2 |
NO2C6H7 |
AB2C6D7 |
-142.25 |
9.77 |
-9.59 |
-0.9 |
0 |
|
|
315788 |
126628776 |
1 |
N5O8C33H43 |
A5B8C33D43 |
-278.86 |
9.66 |
-9.38 |
-1.04 |
0 |
|
|
315789 |
126628777 |
1 |
NO3C20H23 |
AB3C20D23 |
-88.8 |
5.02 |
-8.99 |
-0.88 |
0 |
|
|
315790 |
126628779 |
1 |
N2O5C20H34 |
A2B5C20D34 |
-284.89 |
4.28 |
-9.74 |
-0.32 |
0 |
|
|
315791 |
126628784 |
1 |
N4O7C40H48 |
A4B7C40D48 |
-212.58 |
10.03 |
-9.15 |
-0.79 |
0 |
|
|
315792 |
126628789 |
1 |
N2O5C21H38 |
A2B5C21D38 |
-271.66 |
12.85 |
-9.28 |
0.04 |
0 |
|
|
315793 |
126628794 |
1 |
O2C9H14 |
A2B9C14 |
-73.61 |
4.88 |
-10.06 |
0.52 |
0 |
|
|
315795 |
126628796 |
1 |
NO3C19H23 |
AB3C19D23 |
-86.56 |
7.89 |
-9.91 |
-0.19 |
0 |
|
|
315796 |
126628797 |
1 |
NO3C11H17 |
AB3C11D17 |
-140.12 |
1.77 |
-10.01 |
0.01 |
0 |
|
|
315797 |
126628798 |
1 |
Cl3N3O7C30H34 |
A3B3C7D30E34 |
-294.23 |
3.42 |
-8.74 |
-0.48 |
0 |
|
|
315798 |
126628800 |
1 |
Cl3N6O6C32H39 |
A3B6C6D32E39 |
-214.89 |
3.46 |
-9.45 |
-1.03 |
0 |
|
|
315801 |
126628820 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-91.66 |
3.64 |
-9.22 |
-0.88 |
0 |
|
|
315802 |
126628826 |
1 |
N5O7C34H47 |
A5B7C34D47 |
-287.66 |
4.33 |
-9.08 |
-0.82 |
0 |
|
|
315803 |
126628843 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-139.98 |
5.5 |
-8.96 |
-0.57 |
0 |
|
|
315804 |
126628851 |
1 |
ClNC8H14 |
ABC8D14 |
-10.04 |
2.87 |
-10.04 |
0.18 |
0 |
|
|
315805 |
126628857 |
1 |
FN3O4C17H18 |
AB3C4D17E18 |
-154.59 |
6.54 |
-9.01 |
-0.67 |
0 |
|
|
315807 |
126628860 |
1 |
N5O5C28H35 |
A5B5C28D35 |
-125.41 |
7.79 |
-8.77 |
-0.84 |
0 |
|
|
315808 |
126628899 |
1 |
ClFNO2C15H17 |
ABCD2E15F17 |
-130.17 |
2.08 |
-9.26 |
-0.68 |
0 |
|
|
315810 |
126628912 |
1 |
PN5O6C24H26 |
AB5C6D24E26 |
-228.19 |
13.81 |
-8.79 |
-0.68 |
0 |
|
|
315811 |
126628916 |
1 |
ClF2N3O3H26C30 |
AB2C3D3E26F30 |
-147.29 |
4.66 |
-8.96 |
-0.76 |
0 |
|
|
315813 |
126628922 |
1 |
ClFO3N4C24H24 |
ABC3D4E24F24 |
-128.08 |
4.38 |
-8.66 |
-0.73 |
0 |
|
|
315814 |
126628929 |
1 |
SO2N3C32H43 |
AB2C3D32E43 |
2.24 |
1.12 |
-6.78 |
0.13 |
0 |
|
|
315816 |
126628933 |
1 |
OSN4H30C51 |
ABC4D30E51 |
241.28 |
2.78 |
-8.08 |
-1.29 |
0 |
|
|
315817 |
126628934 |
1 |
O3N4H32C57 |
A3B4C32D57 |
215.04 |
1.58 |
-8.09 |
-1.27 |
0 |
|
|
315820 |
126628938 |
1 |
SN5H35C57 |
AB5C35D57 |
298.18 |
0.74 |
-7.96 |
-1.32 |
0 |
|
|
315822 |
126628942 |
1 |
N5H41C65 |
A5B41C65 |
318.74 |
0.56 |
-7.96 |
-1.22 |
0 |
|
|
315823 |
126628943 |
1 |
OSN4H30C51 |
ABC4D30E51 |
238.76 |
1.44 |
-8.05 |
-1.32 |
0 |
|
|
315824 |
126628951 |
1 |
N3H41C57 |
A3B41C57 |
263.23 |
2.22 |
-7.96 |
-0.54 |
0 |
|
|
315825 |
126628957 |
1 |
ON4H36C51 |
AB4C36D51 |
286.82 |
7.61 |
-8.36 |
-1.76 |
0 |
|
|
315826 |
126628964 |
1 |
N4H34C49 |
A4B34C49 |
224.24 |
3.35 |
-7.98 |
-1.22 |
0 |
|
|
315827 |
126628965 |
1 |
SN4H36C54 |
AB4C36D54 |
257.54 |
2.06 |
-8.26 |
-1.15 |
0 |
|
|
315829 |
126628967 |
1 |
ON4H32C48 |
AB4C32D48 |
207.49 |
1.77 |
-8.34 |
-1.26 |
0 |
|
|
315831 |
126628971 |
1 |
ON4H32C48 |
AB4C32D48 |
196.66 |
2.88 |
-8.02 |
-0.97 |
0 |
|
|
315832 |
126628973 |
1 |
ON2H34C50 |
AB2C34D50 |
174.0 |
2.0 |
-8.05 |
-1.01 |
0 |
|
|
315833 |
126628988 |
1 |
ON6H38C63 |
AB6C38D63 |
310.3 |
3.12 |
-7.94 |
-1.26 |
0 |
|
|
315835 |
126628991 |
1 |
OSN4H34C54 |
ABC4D34E54 |
230.42 |
2.03 |
-8.06 |
-1.36 |
0 |
|
|
315836 |
126628992 |
1 |
ON4H44C67 |
AB4C44D67 |
286.73 |
1.22 |
-8.07 |
-1.33 |
0 |
|
|
315837 |
126628994 |
1 |
ON3H33C49 |
AB3C33D49 |
186.49 |
0.67 |
-8.12 |
-1.18 |
0 |
|
|
315841 |
126629010 |
1 |
ON6H30C50 |
AB6C30D50 |
263.15 |
1.79 |
-8.2 |
-1.34 |
0 |
|
|
315845 |
126629039 |
1 |
ON3H31C50 |
AB3C31D50 |
216.03 |
2.83 |
-8.22 |
-1.27 |
0 |
|
|
315846 |
126629051 |
2 |
N3O4C18H26 |
A3B4C18D26 |
-332.17 |
3.1 |
-8.94 |
-1.16 |
0 |
|
|
315847 |
126629054 |
1 |
N6O7C35H48 |
A6B7C35D48 |
-250.64 |
10.0 |
-9.2 |
-0.86 |
0 |
|
|
315848 |
126629064 |
2 |
N2H20C29 |
A2B20C29 |
270.76 |
4.48 |
-8.14 |
-0.61 |
0 |
|
|
315849 |
126629073 |
2 |
ON2H6C13 |
AB2C6D13 |
139.88 |
6.36 |
-9.98 |
-2.46 |
0 |
|
|
315850 |
126629075 |
1 |
N2H20C29 |
A2B20C29 |
138.79 |
1.35 |
-8.74 |
-1.34 |
0 |
|
|
315851 |
126629076 |
1 |
O2N3H15C26 |
A2B3C15D26 |
94.6 |
4.29 |
-9.5 |
-2.15 |
0 |
|
|
315852 |
126629078 |
1 |
N4O6C29H36 |
A4B6C29D36 |
-211.34 |
5.59 |
-8.8 |
-0.2 |
0 |
|
|
315857 |
126629114 |
1 |
O3N8C40H66 |
A3B8C40D66 |
-31.65 |
11.9 |
-3.42 |
-1.87 |
0 |
|
|
315859 |
126629125 |
1 |
N3H45C65 |
A3B45C65 |
283.81 |
2.77 |
-8.19 |
-0.49 |
0 |
|
|
315860 |
126629128 |
1 |
O5C6H12 |
A5B6C12 |
-235.07 |
1.68 |
-10.41 |
1.16 |
0 |
|
|
315862 |
126629138 |
1 |
NC10H17 |
AB10C17 |
20.12 |
3.08 |
-9.44 |
0.69 |
0 |
|
|
315863 |
126629139 |
1 |
Cl4N5O6C33H43 |
A4B5C6D33E43 |
-273.73 |
2.0 |
-9.19 |
-1.05 |
0 |
|
|
315864 |
126629142 |
1 |
N5O9C35H49 |
A5B9C35D49 |
-370.73 |
2.76 |
-9.07 |
-0.65 |
0 |
|
|
315865 |
126629143 |
2 |
N3O3C16H22 |
A3B3C16D22 |
-223.93 |
3.32 |
-8.75 |
-0.52 |
0 |
|
|
315866 |
126629147 |
1 |
NO2C18H19 |
AB2C18D19 |
-44.06 |
3.81 |
-9.2 |
-0.79 |
0 |
|
|
315869 |
126629155 |
2 |
ClNH6C8 |
ABC6D8 |
62.73 |
6.78 |
-9.32 |
-0.82 |
0 |
|
|
315870 |
126629195 |
1 |
ClO2S2N4C25H25 |
AB2C2D4E25F25 |
10.14 |
6.5 |
-9.06 |
-0.82 |
0 |
|
|
315871 |
126629203 |
1 |
N5O6C32H43 |
A5B6C32D43 |
-154.46 |
6.94 |
-8.59 |
-1.06 |
0 |
|
|
315872 |
126629214 |
1 |
F3O5N6C34H45 |
A3B5C6D34E45 |
-323.99 |
7.47 |
-9.39 |
-1.08 |
0 |