List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
200845 |
79452646 |
1 |
NSO2C11H23 |
ABC2D11E23 |
-107.91 |
8.24 |
-9.63 |
1.32 |
0 |
|
|
200846 |
79452647 |
1 |
NC17H27 |
AB17C27 |
-6.05 |
2.31 |
-8.8 |
0.64 |
0 |
|
|
200847 |
79452648 |
1 |
ClFNC14H19 |
ABCD14E19 |
-40.79 |
2.68 |
-9.1 |
-0.41 |
0 |
|
|
200848 |
79452717 |
1 |
FCl2N3C14H16 |
AB2C3D14E16 |
-7.84 |
3.95 |
-9.91 |
-0.39 |
0 |
|
|
200849 |
79452718 |
1 |
FCl2C17H17 |
AB2C17D17 |
-38.49 |
3.32 |
-9.26 |
-0.04 |
0 |
|
|
200850 |
79452920 |
1 |
Br2N3C10H17 |
A2B3C10D17 |
13.05 |
3.39 |
-9.99 |
-0.58 |
0 |
|
|
200851 |
79453114 |
1 |
Br2N2C11H18 |
A2B2C11D18 |
4.08 |
2.8 |
-9.26 |
-0.29 |
0 |
|
|
200852 |
79453329 |
1 |
FOCl2C12H15 |
ABC2D12E15 |
-91.78 |
5.28 |
-9.69 |
-0.49 |
0 |
|
|
200853 |
79453810 |
1 |
OBr2C13H26 |
AB2C13D26 |
-96.86 |
3.12 |
-9.67 |
-0.29 |
0 |
|
|
200854 |
79454231 |
2 |
ClNC8H10 |
ABC8D10 |
14.12 |
3.23 |
-9.24 |
0.02 |
0 |
|
|
200855 |
79454249 |
1 |
BrClC14H20 |
ABC14D20 |
-25.98 |
1.36 |
-9.59 |
-0.13 |
0 |
|
|
200856 |
79454433 |
1 |
ClNOC14H20 |
ABCD14E20 |
-40.5 |
0.56 |
-8.97 |
0.08 |
0 |
|
|
200857 |
79454434 |
1 |
ClNC17H24 |
ABC17D24 |
-11.56 |
2.01 |
-8.92 |
0.19 |
0 |
|
|
200858 |
79454435 |
1 |
ClNC18H26 |
ABC18D26 |
-19.24 |
3.06 |
-8.92 |
-0.05 |
0 |
|
|
200859 |
79454436 |
1 |
ClNSC15H16 |
ABCD15E16 |
36.75 |
1.82 |
-8.96 |
-0.2 |
0 |
|
|
200860 |
79454450 |
1 |
OBr2H14C15 |
AB2C14D15 |
-4.31 |
4.44 |
-9.47 |
-0.44 |
0 |
|
|
200861 |
79454667 |
1 |
ClNC17H22 |
ABC17D22 |
11.19 |
2.11 |
-8.86 |
0.22 |
0 |
|
|
200862 |
79454922 |
1 |
BrFOC13H18 |
ABCD13E18 |
-93.94 |
1.56 |
-9.62 |
-0.04 |
0 |
|
|
200863 |
79455263 |
1 |
ClOBr2C13H17 |
ABC2D13E17 |
-47.32 |
1.82 |
-9.62 |
-0.44 |
0 |
|
|
200864 |
79455788 |
1 |
FBr3C12H14 |
AB3C12D14 |
-47.01 |
2.13 |
-9.78 |
-0.61 |
0 |
|
|
200865 |
79455789 |
2 |
BrFC6H7 |
ABC6D7 |
-95.57 |
3.2 |
-9.89 |
-0.53 |
0 |
|
|
200866 |
79456012 |
1 |
OBr3C14H19 |
AB3C14D19 |
-41.83 |
4.41 |
-9.56 |
-0.54 |
0 |
|
|
200867 |
79457042 |
1 |
SN3O4C10H15 |
AB3C4D10E15 |
-140.34 |
4.35 |
-9.86 |
-1.1 |
0 |
|
|
200868 |
79457235 |
1 |
NSO4C10H19 |
ABC4D10E19 |
-194.56 |
3.61 |
-9.05 |
-0.06 |
0 |
|
|
200869 |
79457236 |
1 |
N3O6C11H15 |
A3B6C11D15 |
-164.62 |
6.19 |
-10.25 |
-0.86 |
0 |
|
|
200870 |
79457237 |
1 |
N2O5C13H16 |
A2B5C13D16 |
-199.01 |
7.6 |
-9.24 |
-0.41 |
0 |
|
|
200871 |
79457238 |
1 |
NCl2O5C12H13 |
AB2C5D12E13 |
-200.22 |
6.02 |
-9.43 |
-0.89 |
0 |
|
|
200872 |
79457239 |
1 |
NSO4C13H13 |
ABC4D13E13 |
-127.97 |
6.45 |
-9.0 |
-0.84 |
0 |
|
|
200873 |
79457240 |
1 |
NO5C14H17 |
AB5C14D17 |
-195.14 |
7.39 |
-8.93 |
0.09 |
0 |
|
|
200874 |
79457395 |
1 |
N2O4C11H18 |
A2B4C11D18 |
-169.8 |
6.98 |
-9.56 |
0.55 |
0 |
|
|
200875 |
79457477 |
1 |
N4O5C11H18 |
A4B5C11D18 |
-110.55 |
6.79 |
-9.48 |
-0.81 |
0 |
|
|
200876 |
79457514 |
1 |
NO6C13H17 |
AB6C13D17 |
-229.49 |
7.2 |
-9.15 |
-0.42 |
0 |
|
|
200877 |
79457515 |
1 |
NO5C14H19 |
AB5C14D19 |
-208.72 |
1.45 |
-8.81 |
0.02 |
0 |
|
|
200878 |
79457516 |
1 |
NO5C9H17 |
AB5C9D17 |
-229.21 |
5.25 |
-9.88 |
0.59 |
0 |
|
|
200879 |
79457517 |
1 |
INO4C11H12 |
ABC4D11E12 |
-127.82 |
4.7 |
-9.79 |
-1.32 |
0 |
|
|
200880 |
79458054 |
1 |
BrO2N3C15H20 |
AB2C3D15E20 |
-68.63 |
5.61 |
-9.37 |
-0.42 |
0 |
|
|
200881 |
79458055 |
2 |
NC8H13 |
AB8C13 |
-19.61 |
1.67 |
-8.07 |
0.58 |
0 |
|
|
200882 |
79458056 |
1 |
ClN2C13H19 |
AB2C13D19 |
-12.94 |
3.48 |
-8.29 |
0.19 |
0 |
|
|
200883 |
79458057 |
1 |
BrNO4C15H20 |
ABC4D15E20 |
-160.67 |
3.83 |
-9.58 |
-0.52 |
0 |
|
|
200884 |
79458058 |
1 |
BrNOC18H18 |
ABCD18E18 |
-9.12 |
3.69 |
-9.19 |
-0.38 |
0 |
|
|
200885 |
79458059 |
1 |
ClN2C13H19 |
AB2C13D19 |
-3.26 |
1.89 |
-9.09 |
-0.14 |
0 |
|
|
200886 |
79458208 |
1 |
N3C15H31 |
A3B15C31 |
-44.64 |
3.33 |
-8.5 |
2.77 |
0 |
|
|
200887 |
79458762 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-66.31 |
6.11 |
-8.54 |
-0.42 |
0 |
|
|
200888 |
79459145 |
1 |
SO2N3C14H23 |
AB2C3D14E23 |
-79.77 |
5.0 |
-8.61 |
-0.39 |
0 |
|
|
200889 |
79459601 |
1 |
BrNF2H14C16 |
ABC2D14E16 |
-34.91 |
1.88 |
-9.37 |
-0.42 |
0 |
|
|
200890 |
79459602 |
1 |
FNC18H20 |
ABC18D20 |
-0.23 |
1.82 |
-9.31 |
-0.16 |
0 |
|
|
200891 |
79459603 |
1 |
FNSC16H18 |
ABCD16E18 |
1.06 |
2.3 |
-9.07 |
-0.02 |
0 |
|
|
200892 |
79459604 |
1 |
FSN2C14H15 |
ABC2D14E15 |
12.35 |
3.51 |
-9.21 |
-0.47 |
0 |
|
|
200893 |
79459605 |
1 |
NF3H14C16 |
AB3C14D16 |
-83.55 |
1.88 |
-9.39 |
-0.43 |
0 |
|
|
200894 |
79459726 |
1 |
BrClNOC17H17 |
ABCDE17F17 |
14.48 |
4.31 |
-8.89 |
-0.25 |
0 |