List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275875 |
103818577 |
1 |
N3O3C17H27 |
A3B3C17D27 |
-151.27 |
3.04 |
-8.52 |
-0.09 |
0 |
|
|
275876 |
103818583 |
1 |
F2N2O4C15H22 |
A2B2C4D15E22 |
-281.18 |
5.48 |
-8.41 |
0.03 |
0 |
|
|
275877 |
103818598 |
1 |
BrNO3C16H16 |
ABC3D16E16 |
-80.01 |
4.34 |
-8.5 |
-0.17 |
0 |
|
|
275878 |
103818599 |
2 |
NO2C8H12 |
AB2C8D12 |
-179.75 |
2.58 |
-7.88 |
0.35 |
0 |
|
|
275879 |
103818614 |
1 |
N5C16H19 |
A5B16C19 |
102.66 |
4.15 |
-8.88 |
-0.06 |
0 |
|
|
275880 |
103818661 |
1 |
N2O3C18H28 |
A2B3C18D28 |
-153.62 |
4.09 |
-7.75 |
0.4 |
0 |
|
|
275881 |
103818663 |
1 |
N2O4C17H22 |
A2B4C17D22 |
-139.91 |
3.12 |
-7.96 |
0.19 |
0 |
|
|
275882 |
103818665 |
1 |
N2O4C17H26 |
A2B4C17D26 |
-184.31 |
2.98 |
-7.95 |
0.24 |
0 |
|
|
275883 |
103818668 |
1 |
BrN2O2H13C16 |
AB2C2D13E16 |
4.58 |
2.23 |
-8.99 |
-1.0 |
0 |
|
|
275884 |
103818670 |
1 |
BrFON2H12C16 |
ABCD2E12F16 |
-3.7 |
3.55 |
-8.33 |
-0.7 |
0 |
|
|
275885 |
103818676 |
1 |
ON4C15H16 |
AB4C15D16 |
55.27 |
6.69 |
-8.23 |
-0.38 |
0 |
|
|
275886 |
103818743 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-102.07 |
3.79 |
-8.48 |
0.13 |
0 |
|
|
275887 |
103818744 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-52.0 |
3.75 |
-8.32 |
-0.6 |
0 |
|
|
275888 |
103818755 |
1 |
FN6C14H15 |
AB6C14D15 |
69.17 |
9.71 |
-8.71 |
-0.44 |
0 |
|
|
275889 |
103818762 |
2 |
ON2C8H11 |
AB2C8D11 |
-56.21 |
7.23 |
-8.8 |
-0.41 |
0 |
|
|
275890 |
103818779 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-99.11 |
1.93 |
-8.52 |
0.13 |
0 |
|
|
275891 |
103818793 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-52.52 |
4.81 |
-8.52 |
-0.8 |
0 |
|
|
275892 |
103818797 |
1 |
O2N6C15H22 |
A2B6C15D22 |
-24.51 |
9.87 |
-8.82 |
-0.55 |
0 |
|
|
275893 |
103818801 |
1 |
BrN2O3C14H15 |
AB2C3D14E15 |
-65.94 |
3.56 |
-8.24 |
-0.29 |
0 |
|
|
275894 |
103818804 |
1 |
ClFN4H12C15 |
ABC4D12E15 |
58.18 |
2.69 |
-8.44 |
-0.83 |
0 |
|
|
275895 |
103818820 |
1 |
SO2N3H13C15 |
AB2C3D13E15 |
61.36 |
3.51 |
-8.7 |
-1.42 |
0 |
|
|
275896 |
103818832 |
1 |
SN4C15H18 |
AB4C15D18 |
73.58 |
5.11 |
-8.27 |
-0.36 |
0 |
|
|
275897 |
103818847 |
1 |
OSN2C16H16 |
ABC2D16E16 |
49.12 |
4.46 |
-8.37 |
-0.44 |
0 |
|
|
275898 |
103818856 |
1 |
SN2O2H12C15 |
AB2C2D12E15 |
11.11 |
3.81 |
-8.44 |
-0.52 |
0 |
|
|
275899 |
103818861 |
1 |
OSN4C14H16 |
ABC4D14E16 |
46.72 |
3.22 |
-8.42 |
-0.48 |
0 |
|
|
275900 |
103818869 |
1 |
OSN3H13C16 |
ABC3D13E16 |
67.66 |
4.67 |
-8.57 |
-0.89 |
0 |
|
|
275901 |
103818876 |
1 |
SN4C12H12 |
AB4C12D12 |
96.39 |
4.2 |
-8.45 |
-0.5 |
0 |
|
|
275902 |
103818881 |
1 |
OSN2C16H16 |
ABC2D16E16 |
27.3 |
4.16 |
-8.4 |
-0.48 |
0 |
|
|
275903 |
103818882 |
1 |
OF2N2S2H12C14 |
AB2C2D2E12F14 |
-62.72 |
3.86 |
-8.64 |
-0.74 |
0 |
|
|
275904 |
103818887 |
1 |
SN4C14H16 |
AB4C14D16 |
80.58 |
6.44 |
-8.29 |
-0.38 |
0 |
|
|
275905 |
103818956 |
2 |
NO2C8H13 |
AB2C8D13 |
-186.57 |
1.14 |
-8.15 |
-0.01 |
0 |
|
|
275906 |
103818965 |
1 |
BrON3C15H20 |
ABC3D15E20 |
9.56 |
6.71 |
-8.58 |
-0.01 |
0 |
|
|
275907 |
103819002 |
1 |
SN2O2C18H24 |
AB2C2D18E24 |
-76.01 |
4.34 |
-8.44 |
-0.33 |
0 |
|
|
275908 |
103819012 |
1 |
O2N4C17H22 |
A2B4C17D22 |
-55.5 |
5.17 |
-8.15 |
0.09 |
0 |
|
|
275909 |
103819037 |
1 |
N2F3H11C16 |
A2B3C11D16 |
-62.58 |
3.12 |
-8.6 |
-0.98 |
0 |
|
|
275910 |
103819040 |
2 |
N2C8H9 |
A2B8C9 |
79.41 |
3.25 |
-8.28 |
-0.49 |
0 |
|
|
275911 |
103819041 |
1 |
ON2H16C17 |
AB2C16D17 |
14.51 |
1.29 |
-9.21 |
-0.65 |
0 |
|
|
275912 |
103819050 |
1 |
BrFN3O3H7C12 |
ABC3D3E7F12 |
-22.89 |
4.27 |
-9.68 |
-2.13 |
0 |
|
|
275913 |
103819064 |
1 |
NO3C17H17 |
AB3C17D17 |
-98.61 |
5.97 |
-9.36 |
-0.39 |
0 |
|
|
275914 |
103819075 |
1 |
FNO2H16C17 |
ABC2D16E17 |
-98.39 |
3.76 |
-9.49 |
-0.48 |
0 |
|
|
275915 |
103819078 |
1 |
ClN2O2H13C15 |
AB2C2D13E15 |
-36.87 |
3.31 |
-9.45 |
-0.96 |
0 |
|
|
275916 |
103819082 |
1 |
ClINO2H13C16 |
ABCD2E13F16 |
-33.66 |
2.42 |
-9.49 |
-1.5 |
0 |
|
|
275917 |
103819083 |
1 |
BrClNO3C11H13 |
ABCD3E11F13 |
-118.28 |
4.26 |
-9.61 |
-0.9 |
0 |
|
|
275918 |
103819099 |
1 |
BrNO3C13H18 |
ABC3D13E18 |
-138.8 |
1.03 |
-9.35 |
-0.97 |
0 |
|
|
275919 |
103819100 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-92.07 |
5.22 |
-8.51 |
-0.06 |
0 |
|
|
275920 |
103819105 |
1 |
BrON3H10C12 |
ABC3D10E12 |
16.98 |
5.21 |
-9.19 |
-1.18 |
0 |
|
|
275921 |
103819136 |
1 |
BrON2H11C13 |
ABC2D11E13 |
0.12 |
4.25 |
-9.19 |
-0.74 |
0 |
|
|
275922 |
103819144 |
1 |
BrO2N3H10C11 |
AB2C3D10E11 |
-11.67 |
0.99 |
-9.38 |
-0.88 |
0 |
|
|
275923 |
103819193 |
1 |
BrON2C11H15 |
ABC2D11E15 |
-43.77 |
3.2 |
-9.22 |
-0.63 |
0 |
|
|
275924 |
103819198 |
1 |
BrOSN2H11C13 |
ABCD2E11F13 |
9.61 |
3.56 |
-8.85 |
-0.84 |
0 |
|
|
275925 |
103819200 |
1 |
BrON2C12H13 |
ABC2D12E13 |
-14.44 |
2.77 |
-9.27 |
-0.67 |
0 |
|
|
275926 |
103819205 |
1 |
BrOSN3H6C9 |
ABCD3E6F9 |
27.74 |
1.9 |
-9.41 |
-1.7 |
0 |
|
|
275927 |
103819217 |
1 |
BrON2H13C14 |
ABC2D13E14 |
-8.8 |
2.86 |
-9.22 |
-0.64 |
0 |
|
|
275928 |
103819219 |
1 |
BrON2C13H19 |
ABC2D13E19 |
-56.11 |
3.35 |
-9.19 |
-0.61 |
0 |
|
|
275929 |
103819220 |
1 |
BrClN3O3H7C12 |
ABC3D3E7F12 |
1.18 |
3.71 |
-9.64 |
-2.08 |
0 |
|
|
275930 |
103819222 |
1 |
BrN3O3H10C13 |
AB3C3D10E13 |
-2.01 |
4.32 |
-9.52 |
-1.7 |
0 |
|
|
275931 |
103819225 |
1 |
BrON2F4H7C13 |
ABC2D4E7F13 |
-196.83 |
2.19 |
-9.49 |
-1.44 |
0 |
|
|
275932 |
103819235 |
1 |
BrON2C11H13 |
ABC2D11E13 |
-33.37 |
3.18 |
-9.22 |
-0.63 |
0 |
|
|
275933 |
103819245 |
1 |
BrFN3O3H7C12 |
ABC3D3E7F12 |
-36.11 |
4.93 |
-9.62 |
-1.99 |
0 |
|
|
275934 |
103819248 |
1 |
BrON2C12H15 |
ABC2D12E15 |
-40.03 |
3.41 |
-9.16 |
-0.59 |
0 |
|
|
275935 |
103819254 |
1 |
BrSN2O3C9H11 |
ABC2D3E9F11 |
-110.03 |
4.49 |
-9.32 |
-0.75 |
0 |
|
|
275936 |
103819257 |
1 |
BrFN3O3H7C12 |
ABC3D3E7F12 |
-36.0 |
2.32 |
-9.63 |
-2.22 |
0 |
|
|
275937 |
103819263 |
1 |
BrON2C10H11 |
ABC2D10E11 |
-11.57 |
2.53 |
-9.3 |
-0.69 |
0 |
|
|
275938 |
103819275 |
1 |
BrON2H9C12 |
ABC2D9E12 |
10.86 |
3.23 |
-9.27 |
-0.81 |
0 |
|
|
275939 |
103819288 |
1 |
BrClN2O2H12C14 |
ABC2D2E12F14 |
-45.9 |
2.82 |
-9.38 |
-0.82 |
0 |
|
|
275940 |
103819299 |
1 |
BrON2C14H21 |
ABC2D14E21 |
-59.09 |
3.13 |
-9.26 |
-0.66 |
0 |
|
|
275941 |
103819300 |
1 |
BrClON3H9C15 |
ABCD3E9F15 |
36.03 |
4.72 |
-9.56 |
-1.46 |
0 |
|
|
275942 |
103819325 |
1 |
BrON2C9H9 |
ABC2D9E9 |
-2.27 |
2.82 |
-9.26 |
-0.68 |
0 |
|
|
275943 |
103819330 |
1 |
BrClN3O3H7C12 |
ABC3D3E7F12 |
3.64 |
4.98 |
-9.46 |
-1.99 |
0 |
|
|
275944 |
103819343 |
1 |
BrON4C11H11 |
ABC4D11E11 |
14.83 |
6.06 |
-9.07 |
-0.62 |
0 |
|
|
275945 |
103819348 |
1 |
FOBr2N2H7C12 |
ABC2D2E7F12 |
-30.41 |
2.03 |
-9.48 |
-1.37 |
0 |
|
|
275946 |
103819351 |
1 |
OBr2N3H7C11 |
AB2C3D7E11 |
25.93 |
3.39 |
-9.33 |
-1.55 |
0 |
|
|
275947 |
103819356 |
1 |
BrON2C14H19 |
ABC2D14E19 |
-44.72 |
3.33 |
-9.21 |
-0.63 |
0 |
|
|
275948 |
103819358 |
1 |
BrON2F3H6C12 |
ABC2D3E6F12 |
-121.94 |
3.19 |
-9.48 |
-1.42 |
0 |
|
|
275949 |
103819363 |
1 |
BrOSN2C12H15 |
ABCD2E12F15 |
-35.89 |
1.42 |
-8.66 |
-0.75 |
0 |