List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
224657 |
85345769 |
1 |
ClN2O3C16H19 |
AB2C3D16E19 |
-116.52 |
6.95 |
-9.69 |
-1.13 |
0 |
|
|
224658 |
85345771 |
1 |
NO5C17H25 |
AB5C17D25 |
-221.62 |
3.74 |
-9.59 |
0.13 |
0 |
|
|
224659 |
85345772 |
1 |
NO3C20H21 |
AB3C20D21 |
-80.63 |
3.79 |
-8.97 |
0.09 |
0 |
|
|
224660 |
85345783 |
1 |
N4O5C14H20 |
A4B5C14D20 |
-168.24 |
4.69 |
-9.26 |
-0.76 |
0 |
|
|
224661 |
85345786 |
2 |
ON2C9H9 |
AB2C9D9 |
35.27 |
13.16 |
-9.12 |
-2.61 |
0 |
|
|
224662 |
85345787 |
1 |
O5C18H28 |
A5B18C28 |
-261.69 |
5.68 |
-9.85 |
0.51 |
0 |
|
|
224663 |
85345788 |
1 |
O5C18H28 |
A5B18C28 |
-231.89 |
1.55 |
-9.81 |
-0.13 |
0 |
|
|
224664 |
85345799 |
1 |
NO3C20H23 |
AB3C20D23 |
-75.05 |
5.53 |
-9.47 |
-0.66 |
0 |
|
|
224665 |
85345800 |
1 |
NO3C20H23 |
AB3C20D23 |
-103.8 |
4.74 |
-9.56 |
0.14 |
0 |
|
|
224666 |
85345804 |
1 |
NOC22H31 |
ABC22D31 |
-21.5 |
4.47 |
-8.78 |
0.15 |
0 |
|
|
224667 |
85345806 |
1 |
O7C16H22 |
A7B16C22 |
-295.82 |
2.35 |
-9.65 |
0.04 |
0 |
|
|
224668 |
85345807 |
1 |
O5H18C19 |
A5B18C19 |
-144.94 |
3.93 |
-9.39 |
-0.28 |
0 |
|
|
224669 |
85345818 |
1 |
BrOSC15H19 |
ABCD15E19 |
-12.38 |
6.52 |
-8.27 |
0.11 |
0 |
|
|
224670 |
85345819 |
1 |
NO8C14H17 |
AB8C14D17 |
-263.62 |
4.48 |
-10.43 |
-1.71 |
0 |
|
|
224671 |
85345839 |
1 |
ClSN4H13C16 |
ABC4D13E16 |
113.64 |
6.18 |
-8.49 |
-1.23 |
1 |
|
|
224672 |
85345845 |
1 |
N3O4C17H20 |
A3B4C17D20 |
-96.17 |
4.6 |
0.0 |
0.0 |
0 |
|
|
224673 |
85345855 |
1 |
O5C19H22 |
A5B19C22 |
-193.02 |
3.69 |
-9.75 |
-0.38 |
0 |
|
|
224674 |
85345856 |
2 |
O2C10H13 |
A2B10C13 |
-91.33 |
4.47 |
-8.1 |
-0.09 |
0 |
|
|
224675 |
85345857 |
3 |
OC7H10 |
AB7C10 |
-155.49 |
4.09 |
-9.49 |
0.26 |
0 |
|
|
224676 |
85345868 |
1 |
N4O5C15H16 |
A4B5C15D16 |
-154.5 |
3.2 |
-9.69 |
-1.15 |
0 |
|
|
224677 |
85345869 |
1 |
O5C19H24 |
A5B19C24 |
-216.71 |
7.37 |
-9.29 |
-0.83 |
0 |
|
|
224678 |
85345870 |
1 |
O5C19H24 |
A5B19C24 |
-203.64 |
5.59 |
-9.24 |
-0.42 |
0 |
|
|
224679 |
85345872 |
1 |
N2O2H20C21 |
A2B2C20D21 |
50.17 |
9.11 |
-8.84 |
-0.81 |
0 |
|
|
224680 |
85345876 |
2 |
H10C13 |
A10B13 |
115.81 |
0.13 |
-8.4 |
-0.87 |
0 |
|
|
224681 |
85345891 |
1 |
ClF2O4C15H17 |
AB2C4D15E17 |
-252.38 |
4.82 |
-9.96 |
-0.79 |
0 |