List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
318675 |
126652682 |
1 |
SN3O10C52H55 |
AB3C10D52E55 |
-270.07 |
3.18 |
-8.68 |
-1.01 |
0 |
|
|
318677 |
126652684 |
1 |
SN5O14H33C44 |
AB5C14D33E44 |
-348.14 |
6.15 |
-8.49 |
-1.88 |
0 |
|
|
318679 |
126652686 |
3 |
O4H10C13 |
A4B10C13 |
-324.35 |
7.08 |
-9.38 |
-0.87 |
0 |
|
|
318680 |
126652687 |
1 |
SN3O12H35C45 |
AB3C12D35E45 |
-272.83 |
10.04 |
-8.5 |
-0.93 |
0 |
|
|
318682 |
126652689 |
2 |
O5H11C14 |
A5B11C14 |
-294.62 |
2.27 |
-9.12 |
-0.82 |
0 |
|
|
318683 |
126652690 |
1 |
O5H18C25 |
A5B18C25 |
-103.01 |
4.15 |
-8.77 |
-1.01 |
0 |
|
|
318685 |
126652704 |
2 |
FO7C28H30 |
AB7C28D30 |
-625.68 |
4.07 |
-9.24 |
-0.4 |
0 |
|
|
318686 |
126652708 |
1 |
ON2H62C70 |
AB2C62D70 |
162.96 |
2.11 |
-7.9 |
-0.7 |
0 |
|
|
318687 |
126652709 |
1 |
SN3H29C44 |
AB3C29D44 |
232.02 |
5.92 |
-8.11 |
-0.92 |
0 |
|
|
318689 |
126652712 |
1 |
SP2C18H18 |
AB2C18D18 |
64.2 |
4.05 |
-8.29 |
-0.13 |
0 |
|
|
318690 |
126652725 |
1 |
FSO3C12H17 |
ABC3D12E17 |
-180.45 |
3.91 |
-9.8 |
-0.77 |
0 |
|
|
318691 |
126652727 |
1 |
FNSO3C12H16 |
ABCD3E12F16 |
-162.46 |
8.55 |
-9.52 |
-0.97 |
0 |
|
|
318692 |
126652728 |
1 |
FSO3C12H17 |
ABC3D12E17 |
-179.36 |
6.27 |
-9.78 |
-0.85 |
0 |
|
|
318693 |
126652729 |
1 |
FSO3C11H15 |
ABC3D11E15 |
-173.51 |
6.92 |
-9.93 |
-0.88 |
0 |
|
|
318694 |
126652737 |
1 |
FPSO7C12H18 |
ABCD7E12F18 |
-414.74 |
5.56 |
-9.91 |
-0.8 |
0 |
|
|
318695 |
126652739 |
1 |
FPSO8C19H22 |
ABCD8E19F22 |
-426.93 |
4.35 |
-9.26 |
-0.78 |
0 |
|
|
318697 |
126652753 |
1 |
ClFNSO4C29H35 |
ABCDE4F29G35 |
-179.78 |
9.53 |
-9.17 |
-0.81 |
0 |
|
|
318699 |
126652756 |
1 |
ClSN2F4O4C33H33 |
ABC2D4E4F33G33 |
-297.75 |
5.81 |
-9.32 |
-1.1 |
0 |
|
|
318700 |
126652768 |
1 |
SO2F3C10H11 |
AB2C3D10E11 |
-233.18 |
3.38 |
-9.27 |
-0.76 |
0 |
|
|
318702 |
126652773 |
1 |
N2O35C83H152 |
A2B35C83D152 |
-1765.91 |
8.07 |
-9.59 |
-0.1 |
0 |
|
|
318706 |
126652793 |
2 |
N2H27C38 |
A2B27C38 |
321.53 |
3.55 |
-7.95 |
-0.69 |
0 |
|
|
318707 |
126652795 |
1 |
OH56C91 |
AB56C91 |
340.35 |
3.37 |
-8.62 |
-0.77 |
0 |
|
|
318708 |
126652796 |
1 |
N7H61C84 |
A7B61C84 |
414.57 |
3.17 |
-7.8 |
-1.3 |
0 |
|
|
318709 |
126652797 |
2 |
N2H21C28 |
A2B21C28 |
244.43 |
2.04 |
-8.01 |
-0.4 |
0 |
|
|
318710 |
126652798 |
1 |
N6H76C105 |
A6B76C105 |
448.5 |
5.37 |
-7.9 |
-0.66 |
0 |
|
|
318711 |
126652799 |
2 |
O7C10H13 |
A7B10C13 |
-546.82 |
1.14 |
-10.42 |
-0.6 |
0 |
|
|
318714 |
126652805 |
2 |
OC8H11 |
AB8C11 |
-93.62 |
2.41 |
-9.37 |
-0.56 |
0 |
|
|
318715 |
126652807 |
1 |
OC13H24 |
AB13C24 |
-70.03 |
3.27 |
-8.93 |
1.49 |
0 |
|
|
318716 |
126652809 |
1 |
F2H16C17 |
A2B16C17 |
-52.83 |
0.53 |
-8.96 |
-0.5 |
0 |
|
|
318717 |
126652835 |
1 |
NSC18H19 |
ABC18D19 |
45.42 |
1.69 |
-8.51 |
-0.66 |
0 |
|
|
318722 |
126652881 |
1 |
ClN3O3C32H36 |
AB3C3D32E36 |
-60.43 |
7.41 |
-8.34 |
-0.64 |
0 |
|
|
318730 |
126652934 |
1 |
BrNF3O3H23C25 |
ABC3D3E23F25 |
-204.2 |
3.0 |
-9.79 |
-1.11 |
0 |
|
|
318732 |
126652975 |
1 |
NOH31C52 |
ABC31D52 |
226.19 |
1.58 |
-8.26 |
-1.03 |
0 |
|
|
318733 |
126652977 |
1 |
NOH29C50 |
ABC29D50 |
221.76 |
2.37 |
-8.05 |
-0.84 |
0 |
|
|
318734 |
126652979 |
1 |
NSH27C46 |
ABC27D46 |
227.29 |
3.17 |
-8.32 |
-1.1 |
0 |
|
|
318735 |
126652985 |
1 |
OH32C55 |
AB32C55 |
270.66 |
1.35 |
-8.3 |
-1.04 |
0 |
|
|
318737 |
126652987 |
1 |
NOH27C46 |
ABC27D46 |
202.4 |
2.9 |
-8.31 |
-1.11 |
0 |
|
|
318738 |
126652988 |
1 |
SH30C51 |
AB30C51 |
226.16 |
0.79 |
-8.36 |
-0.87 |
0 |
|
|
318739 |
126652996 |
1 |
OH34C59 |
AB34C59 |
279.55 |
1.25 |
-8.46 |
-1.01 |
0 |
|
|
318740 |
126653001 |
1 |
NOH31C54 |
ABC31D54 |
228.6 |
1.75 |
-8.44 |
-0.93 |
0 |
|
|
318741 |
126653005 |
1 |
NOH29C50 |
ABC29D50 |
211.92 |
1.61 |
-8.44 |
-0.9 |
0 |
|
|
318743 |
126653014 |
1 |
NSH33C56 |
ABC33D56 |
260.18 |
1.36 |
-8.41 |
-0.97 |
0 |
|
|
318744 |
126653018 |
1 |
OH34C55 |
AB34C55 |
240.81 |
1.53 |
-8.08 |
-0.85 |
0 |
|
|
318746 |
126653021 |
1 |
BrNSH14C26 |
ABCD14E26 |
145.6 |
2.34 |
-8.61 |
-1.04 |
0 |
|
|
318748 |
126653027 |
1 |
N3H21C31 |
A3B21C31 |
170.04 |
0.08 |
-8.87 |
-1.11 |
0 |
|
|
318749 |
126653028 |
1 |
PO9C90H123 |
AB9C90D123 |
-462.6 |
7.99 |
-8.83 |
-0.29 |
0 |
|
|
318752 |
126653035 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-82.11 |
6.08 |
-8.61 |
-0.58 |
0 |
|
|
318755 |
126653041 |
1 |
ClNO3H18C19 |
ABC3D18E19 |
-51.56 |
4.59 |
-8.74 |
-0.72 |
0 |
|
|
318757 |
126653047 |
1 |
ClNO3C15H18 |
ABC3D15E18 |
-87.54 |
4.91 |
-8.76 |
-0.73 |
0 |
|
|
318761 |
126653067 |
1 |
ClSN2O5H21C23 |
ABC2D5E21F23 |
-110.44 |
4.15 |
-8.55 |
-0.92 |
0 |