List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
261850 |
103255258 |
1 |
NO3C17H25 |
AB3C17D25 |
-138.8 |
4.88 |
-9.38 |
-0.28 |
0 |
|
|
261851 |
103255326 |
1 |
NO2C11H17 |
AB2C11D17 |
-82.91 |
5.84 |
-9.5 |
0.71 |
0 |
|
|
261852 |
103255332 |
1 |
NO3C16H17 |
AB3C16D17 |
-67.91 |
6.73 |
-9.23 |
-1.16 |
0 |
|
|
261853 |
103255432 |
1 |
NO2F3C14H16 |
AB2C3D14E16 |
-224.32 |
4.04 |
-8.76 |
-0.51 |
0 |
|
|
261854 |
103255445 |
1 |
N2O3C10H18 |
A2B3C10D18 |
-112.51 |
7.61 |
-8.89 |
-0.32 |
0 |
|
|
261855 |
103255447 |
1 |
N2O3C11H20 |
A2B3C11D20 |
-121.28 |
8.31 |
-9.11 |
-0.1 |
0 |
|
|
261856 |
103255460 |
1 |
N2O3C9H16 |
A2B3C9D16 |
-120.53 |
8.44 |
-9.16 |
0.06 |
0 |
|
|
261857 |
103255467 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-81.73 |
4.19 |
-9.24 |
-0.29 |
0 |
|
|
261858 |
103255505 |
1 |
N2O5C12H20 |
A2B5C12D20 |
-224.48 |
5.51 |
-9.56 |
0.09 |
0 |
|
|
261859 |
103255514 |
1 |
N2O5C13H16 |
A2B5C13D16 |
-191.53 |
6.01 |
-9.96 |
-0.52 |
0 |
|
|
261860 |
103255535 |
1 |
N3O5C11H13 |
A3B5C11D13 |
-145.38 |
4.31 |
-10.23 |
-1.13 |
0 |
|
|
261861 |
103255588 |
1 |
N2O3H12C14 |
A2B3C12D14 |
-23.8 |
6.11 |
-8.96 |
-1.45 |
0 |
|
|
261862 |
103255647 |
2 |
NO2C5H8 |
AB2C5D8 |
-128.63 |
6.81 |
-9.57 |
0.22 |
0 |
|
|
261863 |
103255684 |
1 |
NO3C12H23 |
AB3C12D23 |
-154.76 |
3.48 |
-9.42 |
0.74 |
0 |
|
|
261864 |
103255716 |
1 |
NO3C9H15 |
AB3C9D15 |
-125.84 |
2.5 |
-9.22 |
0.02 |
0 |
|
|
261865 |
103255724 |
1 |
NO3C12H23 |
AB3C12D23 |
-166.4 |
4.49 |
-9.26 |
0.86 |
0 |
|
|
261866 |
103255813 |
1 |
SN2O3H8C9 |
AB2C3D8E9 |
-22.62 |
4.47 |
-8.66 |
-1.3 |
0 |
|
|
261867 |
103255846 |
1 |
N2O2C11H16 |
A2B2C11D16 |
-55.42 |
6.25 |
-8.2 |
-0.68 |
0 |
|
|
261868 |
103255895 |
1 |
NO3C8H13 |
AB3C8D13 |
-113.96 |
4.32 |
-9.73 |
-0.56 |
0 |
|
|
261869 |
103255999 |
1 |
NO4C10H19 |
AB4C10D19 |
-183.12 |
6.59 |
-9.56 |
-0.12 |
0 |
|
|
261870 |
103256132 |
1 |
NO3C13H25 |
AB3C13D25 |
-156.13 |
1.9 |
-9.39 |
-0.17 |
0 |
|
|
261871 |
103256239 |
1 |
NO5C13H15 |
AB5C13D15 |
-166.81 |
7.16 |
-9.8 |
-1.32 |
0 |
|
|
261872 |
103256288 |
1 |
FIO2N3H9C12 |
ABC2D3E9F12 |
-38.76 |
4.88 |
-8.71 |
-1.91 |
0 |
|
|
261873 |
103256427 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-91.1 |
3.27 |
-9.62 |
-0.72 |
0 |
|
|
261874 |
103256438 |
1 |
N2O3C9H14 |
A2B3C9D14 |
-110.03 |
6.17 |
-9.51 |
-0.16 |
0 |
|
|
261875 |
103256510 |
1 |
NO3C12H23 |
AB3C12D23 |
-147.58 |
3.98 |
-9.44 |
-0.14 |
0 |
|
|
261876 |
103256565 |
1 |
BrClNO3H11C13 |
ABCD3E11F13 |
-73.04 |
6.05 |
-8.99 |
-1.08 |
0 |
|
|
261877 |
103256585 |
1 |
NO2C18H29 |
AB2C18D29 |
-113.04 |
3.11 |
-9.14 |
0.67 |
0 |
|
|
261878 |
103256597 |
1 |
NO2C18H29 |
AB2C18D29 |
-124.56 |
2.69 |
-9.03 |
-0.06 |
0 |
|
|
261879 |
103256603 |
1 |
NO3C12H23 |
AB3C12D23 |
-160.77 |
3.75 |
-9.68 |
0.44 |
0 |
|
|
261880 |
103256609 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-58.41 |
8.65 |
-9.67 |
-0.39 |
0 |
|
|
261881 |
103256680 |
1 |
NO3C15H23 |
AB3C15D23 |
-119.68 |
3.95 |
-9.21 |
-0.45 |
0 |
|
|
261882 |
103256684 |
1 |
NO2C17H25 |
AB2C17D25 |
-97.05 |
6.28 |
-9.12 |
-0.15 |
0 |
|
|
261883 |
103256810 |
1 |
N3O3C11H13 |
A3B3C11D13 |
-50.11 |
5.42 |
-8.83 |
-0.76 |
0 |
|
|
261884 |
103256813 |
1 |
FSO2N3H12C14 |
ABC2D3E12F14 |
-42.71 |
4.61 |
-8.33 |
-1.4 |
0 |
|
|
261885 |
103256842 |
1 |
N3O3C9H11 |
A3B3C9D11 |
-59.41 |
4.87 |
-9.68 |
-1.71 |
0 |
|
|
261886 |
103257022 |
1 |
BrNO4C10H18 |
ABC4D10E18 |
-193.13 |
4.35 |
-8.98 |
-0.9 |
0 |
|
|
261887 |
103257025 |
1 |
NO4C10H17 |
AB4C10D17 |
-170.77 |
5.76 |
-9.62 |
-0.4 |
0 |
|
|
261888 |
103257064 |
1 |
NSO4C11H19 |
ABC4D11E19 |
-163.91 |
4.37 |
-9.56 |
0.49 |
0 |
|
|
261889 |
103257142 |
1 |
FNO3C12H16 |
ABC3D12E16 |
-158.78 |
2.93 |
-9.87 |
-0.32 |
0 |
|
|
261890 |
103257166 |
1 |
FN2O3C13H13 |
AB2C3D13E13 |
-85.72 |
6.38 |
-9.75 |
-1.12 |
0 |
|
|
261891 |
103257215 |
1 |
ClNO3C16H18 |
ABC3D16E18 |
-85.52 |
2.72 |
-9.46 |
-0.55 |
0 |
|
|
261892 |
103257235 |
1 |
ClNO2C17H18 |
ABC2D17E18 |
-60.53 |
4.07 |
-9.45 |
-0.36 |
0 |
|
|
261893 |
103257261 |
1 |
O3N4C13H14 |
A3B4C13D14 |
-51.68 |
3.65 |
-8.82 |
-1.69 |
0 |
|
|
261894 |
103257414 |
1 |
NSO2C16H19 |
ABC2D16E19 |
-56.25 |
8.4 |
-9.27 |
-1.02 |
0 |
|
|
261895 |
103257418 |
1 |
FNO3C14H20 |
ABC3D14E20 |
-163.67 |
1.9 |
-9.04 |
-0.12 |
0 |
|
|
261896 |
103257474 |
1 |
FNO3H14C15 |
ABC3D14E15 |
-120.57 |
5.26 |
-8.65 |
-0.88 |
0 |
|
|
261897 |
103257679 |
1 |
NSO3C15H17 |
ABC3D15E17 |
-75.24 |
5.78 |
-9.0 |
-1.29 |
0 |
|
|
261898 |
103257884 |
1 |
NO2C14H25 |
AB2C14D25 |
-115.02 |
4.15 |
-9.23 |
-0.29 |
0 |
|
|
261899 |
103257993 |
1 |
NO2S2C13H19 |
AB2C2D13E19 |
-81.1 |
3.73 |
-8.71 |
-1.14 |
0 |
|
|
261900 |
103258013 |
1 |
SO2N4C11H14 |
AB2C4D11E14 |
-10.94 |
2.96 |
-9.05 |
-1.14 |
0 |
|
|
261901 |
103258039 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-62.81 |
2.25 |
-9.09 |
-1.64 |
0 |
|
|
261902 |
103258133 |
1 |
NSO2C15H17 |
ABC2D15E17 |
-47.08 |
3.65 |
-9.14 |
-1.15 |
0 |
|
|
261903 |
103258138 |
1 |
NO2C13H17 |
AB2C13D17 |
-61.37 |
7.31 |
-9.58 |
-0.11 |
0 |
|
|
261904 |
103258200 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-72.02 |
5.69 |
-9.76 |
-0.81 |
0 |
|
|
261905 |
103258201 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-66.09 |
4.92 |
-9.5 |
-0.66 |
0 |
|
|
261906 |
103258203 |
1 |
O2N5C12H15 |
A2B5C12D15 |
4.23 |
6.55 |
-9.94 |
-0.81 |
0 |
|
|
261907 |
103258424 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-89.3 |
6.69 |
-9.12 |
-1.34 |
0 |
|
|
261908 |
103258441 |
1 |
NO4C8H15 |
AB4C8D15 |
-187.13 |
4.21 |
-9.71 |
0.31 |
0 |
|
|
261909 |
103258567 |
1 |
NO3C14H19 |
AB3C14D19 |
-101.28 |
4.52 |
-8.53 |
-0.14 |
0 |
|
|
261910 |
103258695 |
1 |
FNO2C15H22 |
ABC2D15E22 |
-138.51 |
3.57 |
-9.39 |
-0.3 |
0 |
|
|
261911 |
103258696 |
1 |
FO2N3C14H14 |
AB2C3D14E14 |
-72.87 |
4.39 |
-10.13 |
-1.37 |
0 |
|
|
261912 |
103258758 |
1 |
FNO2C12H14 |
ABC2D12E14 |
-101.14 |
5.88 |
-9.9 |
-0.38 |
0 |
|
|
261913 |
103258808 |
1 |
N3O3H13C15 |
A3B3C13D15 |
-4.22 |
6.94 |
-9.45 |
-1.0 |
0 |
|
|
261914 |
103258824 |
1 |
NO3C16H19 |
AB3C16D19 |
-97.77 |
6.98 |
-9.32 |
-0.24 |
0 |
|
|
261915 |
103258835 |
1 |
NO3C16H19 |
AB3C16D19 |
-90.97 |
8.29 |
-9.19 |
-0.63 |
0 |
|
|
261916 |
103258880 |
1 |
NO2C13H17 |
AB2C13D17 |
-71.2 |
5.77 |
-8.89 |
-0.09 |
0 |
|
|
261917 |
103258899 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-100.92 |
3.04 |
-10.24 |
-0.4 |
0 |
|
|
261918 |
103258901 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-72.35 |
4.75 |
-9.7 |
-0.78 |
0 |
|
|
261919 |
103259004 |
1 |
NO4C13H21 |
AB4C13D21 |
-164.32 |
6.53 |
-9.4 |
-0.77 |
0 |
|
|
261920 |
103259016 |
1 |
O2N3C9H21 |
A2B3C9D21 |
-113.48 |
2.98 |
-9.45 |
0.98 |
0 |
|
|
261921 |
103259188 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-86.76 |
5.4 |
-9.72 |
-0.84 |
0 |
|
|
261922 |
103259189 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-127.18 |
5.55 |
-9.51 |
-0.25 |
0 |
|
|
261923 |
103259225 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-90.55 |
5.8 |
-9.72 |
-0.7 |
0 |
|
|
261924 |
103259330 |
1 |
BrClNO2H15C16 |
ABCD2E15F16 |
-56.69 |
3.41 |
-9.19 |
-0.67 |
0 |