List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
18777 |
547993 |
1 |
OC10H20 |
AB10C20 |
-70.15 |
1.85 |
-9.9 |
1.09 |
0 |
|
|
18778 |
548131 |
1 |
FN2O2C11H11 |
AB2C2D11E11 |
-116.81 |
6.3 |
-9.51 |
-0.73 |
0 |
|
|
18779 |
548175 |
1 |
NO3S3C22H25 |
AB3C3D22E25 |
-15.1 |
4.16 |
-8.53 |
-1.17 |
0 |
|
|
18780 |
548176 |
1 |
NO2C23H27 |
AB2C23D27 |
-53.41 |
1.11 |
-8.47 |
-0.14 |
0 |
|
|
18781 |
548178 |
1 |
O2C27H46 |
A2B27C46 |
-177.35 |
4.28 |
-9.24 |
1.37 |
0 |
|
|
18782 |
548179 |
1 |
ClN4O4C20H25 |
AB4C4D20E25 |
-139.14 |
6.3 |
-9.53 |
-0.82 |
0 |
|
|
18783 |
548200 |
1 |
SN2O4C8H14 |
AB2C4D8E14 |
-185.15 |
4.51 |
-9.56 |
-0.38 |
0 |
|
|
18784 |
548203 |
1 |
O3C6H10 |
A3B6C10 |
-121.14 |
0.9 |
-8.98 |
0.44 |
0 |
|
|
18785 |
548204 |
1 |
NO4C6H11 |
AB4C6D11 |
-186.24 |
3.96 |
-10.23 |
0.06 |
0 |
|
|
18786 |
548235 |
1 |
OSC7H14 |
ABC7D14 |
-75.66 |
2.61 |
-8.66 |
0.72 |
0 |
|
|
18787 |
548236 |
1 |
NOSC11H11 |
ABCD11E11 |
3.32 |
4.36 |
-9.17 |
-0.8 |
0 |
|
|
18788 |
548237 |
1 |
OSN2C8H8 |
ABC2D8E8 |
10.58 |
3.42 |
-9.29 |
-0.69 |
0 |
|
|
18789 |
548247 |
2 |
O2C3H6 |
A2B3C6 |
-193.18 |
1.54 |
-10.31 |
1.38 |
0 |
|
|
18790 |
548264 |
1 |
NO2C12H25 |
AB2C12D25 |
-59.43 |
1.36 |
-8.76 |
0.52 |
0 |
|
|
18791 |
548271 |
1 |
SO2C8H14 |
AB2C8D14 |
-105.02 |
3.25 |
-8.98 |
0.14 |
0 |
|
|
18792 |
548322 |
2 |
OSC4H9 |
ABC4D9 |
-106.95 |
4.3 |
-8.68 |
0.38 |
0 |
|
|
18793 |
548338 |
1 |
N3O5C8H13 |
A3B5C8D13 |
-170.21 |
4.82 |
-9.61 |
-0.3 |
0 |
|
|
18794 |
548368 |
1 |
SO2C6H10 |
AB2C6D10 |
-81.99 |
2.12 |
-9.34 |
-0.17 |
0 |
|
|
18795 |
548378 |
1 |
S2O3C11H14 |
A2B3C11D14 |
-94.58 |
1.3 |
-8.99 |
-0.74 |
0 |
|
|
18796 |
548379 |
1 |
SO4C7H12 |
AB4C7D12 |
-185.27 |
4.68 |
-9.36 |
-0.38 |
0 |
|
|
18797 |
548380 |
1 |
BClC6H14 |
ABC6D14 |
-73.67 |
1.83 |
-10.09 |
0.23 |
0 |
|
|
18798 |
548381 |
1 |
ClO2C5H11 |
AB2C5D11 |
-111.22 |
2.09 |
-10.33 |
0.61 |
0 |
|
|
18799 |
548394 |
1 |
SO3C6H14 |
AB3C6D14 |
-136.33 |
2.17 |
-8.88 |
0.48 |
0 |
|
|
18800 |
548430 |
1 |
NO3H11C20 |
AB3C11D20 |
-10.33 |
2.76 |
-8.94 |
-1.79 |
0 |
|
|
18801 |
548480 |
1 |
ClBr2N4H13C17 |
AB2C4D13E17 |
78.57 |
3.23 |
-8.77 |
-0.88 |
0 |
|
|
18802 |
548484 |
1 |
ON4H6C8 |
AB4C6D8 |
62.05 |
2.31 |
-10.17 |
-1.41 |
0 |
|
|
18803 |
548495 |
1 |
ClON2H4C6 |
ABC2D4E6 |
30.54 |
3.6 |
0.0 |
0.0 |
1 |
|
|
18804 |
548497 |
1 |
AsS2C3H3F6 |
AB2C3D3E6 |
-333.87 |
4.44 |
-9.98 |
-1.86 |
0 |
|
|
18805 |
548500 |
1 |
Cl3N5C13H14 |
A3B5C13D14 |
81.32 |
8.27 |
-9.15 |
-1.03 |
0 |
|
|
18806 |
548513 |
1 |
S2Cl3C4O4H7 |
A2B3C4D4E7 |
-159.27 |
1.97 |
-10.63 |
-0.77 |
0 |
|
|
18807 |
548514 |
1 |
BrOF3N3H9C13 |
ABC3D3E9F13 |
-113.07 |
6.69 |
-8.96 |
-1.23 |
0 |
|
|
18808 |
548515 |
1 |
N2O3H6C7 |
A2B3C6D7 |
32.89 |
5.98 |
-8.78 |
-1.54 |
0 |
|
|
18809 |
548532 |
1 |
NCl2O3H11C16 |
AB2C3D11E16 |
-41.15 |
2.48 |
-9.22 |
-1.74 |
0 |
|
|
18810 |
548587 |
1 |
SCl2O3N5H13C20 |
AB2C3D5E13F20 |
2.83 |
7.69 |
-9.56 |
-2.04 |
0 |
|
|
18811 |
548599 |
1 |
ClNC2F3H3 |
ABC2D3E3 |
-100.72 |
2.12 |
-10.78 |
-1.15 |
0 |
|
|
18812 |
548600 |
1 |
H3C4N5 |
A3B4C5 |
134.25 |
6.85 |
-10.82 |
-1.76 |
0 |
|
|
18813 |
548602 |
1 |
O2N4H6C7 |
A2B4C6D7 |
88.55 |
6.8 |
-9.65 |
-1.29 |
0 |
|
|
18814 |
548605 |
1 |
FNO3H10C13 |
ABC3D10E13 |
-44.58 |
6.15 |
-9.71 |
-1.29 |
0 |
|
|
18815 |
548643 |
1 |
OCl2C6H6 |
AB2C6D6 |
-24.56 |
3.63 |
-10.32 |
-0.57 |
0 |
|
|
18816 |
548651 |
1 |
N2O2H6C7 |
A2B2C6D7 |
8.06 |
4.16 |
-9.68 |
-1.74 |
0 |
|
|
18817 |
548666 |
1 |
O5N7C35H35 |
A5B7C35D35 |
-56.34 |
5.75 |
-9.08 |
-1.55 |
0 |
|
|
18818 |
548674 |
1 |
O3C11H12 |
A3B11C12 |
-98.04 |
5.97 |
-10.48 |
-0.24 |
0 |
|
|
18819 |
548675 |
1 |
SiCl2C5H6 |
AB2C5D6 |
-63.29 |
2.29 |
-9.35 |
-0.34 |
0 |
|
|
18820 |
548677 |
1 |
OC11H16 |
AB11C16 |
-31.79 |
1.64 |
-9.49 |
1.3 |
-2 |
|
|
18821 |
548678 |
1 |
NOC6H7 |
ABC6D7 |
-1.22 |
4.15 |
-9.92 |
0.22 |
0 |
|
|
18822 |
548718 |
1 |
OC8H12 |
AB8C12 |
-40.29 |
3.39 |
-9.85 |
0.62 |
0 |
|
|
18823 |
548720 |
2 |
C5H8 |
A5B8 |
6.44 |
0.6 |
-9.56 |
1.26 |
0 |
|
|
18824 |
548723 |
2 |
OC4H5 |
AB4C5 |
-54.31 |
1.77 |
-9.84 |
0.51 |
0 |
|
|
18825 |
548724 |
1 |
OC10H14 |
AB10C14 |
-3.51 |
2.27 |
-9.64 |
1.02 |
0 |
|
|
18826 |
548732 |
1 |
O3C10H12 |
A3B10C12 |
-29.71 |
5.02 |
-10.0 |
-0.51 |
0 |