List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
292900 |
117362982 |
1 |
ON2C15H20 |
AB2C15D20 |
-34.83 |
5.53 |
-8.27 |
0.08 |
0 |
|
|
292901 |
117362991 |
1 |
ON2C15H20 |
AB2C15D20 |
-17.44 |
2.28 |
-9.13 |
-0.5 |
0 |
|
|
292902 |
117362993 |
1 |
ON2C15H20 |
AB2C15D20 |
-41.29 |
2.41 |
-8.73 |
-0.11 |
0 |
|
|
292903 |
117362997 |
1 |
ON2C15H20 |
AB2C15D20 |
-6.44 |
2.27 |
-8.0 |
0.16 |
0 |
|
|
292904 |
117363043 |
1 |
ON2C15H20 |
AB2C15D20 |
-3.41 |
1.66 |
-8.73 |
-0.14 |
0 |
|
|
292905 |
117363058 |
1 |
ON2C15H20 |
AB2C15D20 |
-35.09 |
1.81 |
-8.73 |
-0.05 |
0 |
|
|
292906 |
117363153 |
1 |
ON2C15H20 |
AB2C15D20 |
-16.71 |
3.8 |
-8.06 |
0.18 |
0 |
|
|
292907 |
117363492 |
2 |
NC8H12 |
AB8C12 |
6.52 |
1.98 |
-8.73 |
0.31 |
0 |
|
|
292908 |
117363495 |
2 |
NC8H12 |
AB8C12 |
8.27 |
2.37 |
-8.65 |
0.38 |
0 |
|
|
292909 |
117363738 |
1 |
ClO4C11H13 |
AB4C11D13 |
-168.56 |
5.38 |
-9.28 |
-0.66 |
0 |
|
|
292910 |
117363739 |
1 |
ClO4C11H13 |
AB4C11D13 |
-174.65 |
3.31 |
-8.63 |
-0.06 |
0 |
|
|
292911 |
117363778 |
1 |
ClFO2C12H14 |
ABC2D12E14 |
-148.34 |
5.25 |
-9.66 |
-0.49 |
0 |
|
|
292912 |
117363813 |
1 |
ClFO2C12H14 |
ABC2D12E14 |
-147.45 |
4.8 |
-9.72 |
-0.52 |
0 |
|
|
292913 |
117363857 |
1 |
ClO3C12H17 |
AB3C12D17 |
-130.11 |
4.92 |
-8.82 |
-0.18 |
0 |
|
|
292914 |
117363870 |
1 |
ClO3C12H17 |
AB3C12D17 |
-123.57 |
3.28 |
-8.31 |
-0.08 |
0 |
|
|
292915 |
117363886 |
1 |
ClO3C12H17 |
AB3C12D17 |
-134.5 |
3.49 |
-9.28 |
-0.37 |
0 |
|
|
292916 |
117363935 |
1 |
ClFOC13H18 |
ABCD13E18 |
-117.02 |
1.64 |
-9.4 |
-0.08 |
0 |
|
|
292917 |
117364086 |
1 |
BrO2C10H13 |
AB2C10D13 |
-71.32 |
2.3 |
-9.42 |
-0.14 |
0 |
|
|
292918 |
117365089 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-30.55 |
5.58 |
-9.08 |
-0.47 |
0 |
|
|
292919 |
117365110 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-36.95 |
6.29 |
-9.14 |
-0.6 |
0 |
|
|
292920 |
117365139 |
1 |
O2N3C13H15 |
A2B3C13D15 |
2.48 |
3.78 |
-8.19 |
-0.92 |
0 |
|
|
292921 |
117365153 |
1 |
O2N3C13H15 |
A2B3C13D15 |
7.03 |
3.25 |
-8.25 |
-0.15 |
0 |
|
|
292922 |
117365235 |
1 |
FNOC15H16 |
ABCD15E16 |
-67.47 |
4.74 |
-9.54 |
-0.2 |
0 |
|
|
292923 |
117365265 |
1 |
FN3C14H16 |
AB3C14D16 |
2.06 |
5.79 |
-9.07 |
-0.74 |
0 |
|
|
292924 |
117365271 |
1 |
FN3C14H16 |
AB3C14D16 |
17.91 |
5.13 |
-9.09 |
-0.75 |
0 |
|
|
292925 |
117365281 |
1 |
FNSO2C11H16 |
ABCD2E11F16 |
-111.49 |
5.03 |
-8.75 |
-0.55 |
0 |
|
|
292926 |
117365332 |
1 |
NO2C15H19 |
AB2C15D19 |
-60.07 |
6.51 |
-8.28 |
0.17 |
0 |
|
|
292927 |
117365339 |
1 |
NO2C15H19 |
AB2C15D19 |
-55.45 |
3.67 |
-9.05 |
0.06 |
0 |
|
|
292928 |
117365372 |
1 |
NO2C15H19 |
AB2C15D19 |
-37.04 |
2.03 |
-8.77 |
-0.08 |
0 |
|
|
292929 |
117365386 |
1 |
NO2C15H19 |
AB2C15D19 |
-54.02 |
4.19 |
-9.65 |
-0.19 |
0 |
|
|
292930 |
117365389 |
1 |
NO2C15H19 |
AB2C15D19 |
-67.59 |
3.27 |
-8.99 |
-0.05 |
0 |
|
|
292931 |
117365435 |
1 |
NO2C15H19 |
AB2C15D19 |
-56.28 |
4.41 |
-8.82 |
-0.21 |
0 |
|
|
292932 |
117365452 |
1 |
NO2C15H19 |
AB2C15D19 |
-59.28 |
1.59 |
-7.99 |
-0.15 |
0 |
|
|
292933 |
117365456 |
1 |
NO2C15H19 |
AB2C15D19 |
-85.0 |
4.85 |
-9.13 |
0.26 |
0 |
|
|
292934 |
117365524 |
1 |
ON3C14H19 |
AB3C14D19 |
-8.41 |
3.67 |
-9.1 |
-0.25 |
0 |
|
|
292935 |
117365525 |
1 |
ON3C14H19 |
AB3C14D19 |
-10.33 |
5.78 |
-8.94 |
-0.14 |
0 |
|
|
292936 |
117365526 |
1 |
ON3C14H19 |
AB3C14D19 |
-11.44 |
3.97 |
-8.7 |
0.1 |
0 |
|
|
292937 |
117365593 |
1 |
ON3C14H19 |
AB3C14D19 |
11.36 |
3.57 |
-8.7 |
0.02 |
0 |
|
|
292938 |
117365607 |
1 |
ON3C14H19 |
AB3C14D19 |
-9.19 |
2.77 |
-9.03 |
-0.24 |
0 |
|
|
292939 |
117365609 |
1 |
ON3C14H19 |
AB3C14D19 |
-11.42 |
3.09 |
-8.76 |
-0.01 |
0 |
|
|
292940 |
117365628 |
1 |
ON3C14H19 |
AB3C14D19 |
0.54 |
4.06 |
-8.6 |
0.11 |
0 |
|
|
292941 |
117365639 |
1 |
ON3C14H19 |
AB3C14D19 |
-20.31 |
4.74 |
-8.74 |
-0.08 |
0 |
|
|
292942 |
117365642 |
1 |
ON3C14H19 |
AB3C14D19 |
-10.06 |
3.32 |
-8.65 |
-0.04 |
0 |
|
|
292943 |
117365783 |
1 |
SN3C13H15 |
AB3C13D15 |
54.08 |
3.21 |
-8.13 |
-0.01 |
0 |
|
|
292944 |
117365817 |
1 |
NOSC14H15 |
ABCD14E15 |
-6.84 |
2.75 |
-8.53 |
-0.32 |
0 |
|
|
292945 |
117365835 |
1 |
NO2S2C10H15 |
AB2C2D10E15 |
-65.59 |
3.49 |
-9.03 |
-0.76 |
0 |
|
|
292946 |
117365836 |
1 |
NO2S2C10H15 |
AB2C2D10E15 |
-62.06 |
6.47 |
-8.63 |
-0.67 |
0 |
|
|
292947 |
117366103 |
1 |
NOC16H23 |
ABC16D23 |
-41.13 |
2.2 |
-8.45 |
0.45 |
0 |
|
|
292948 |
117366114 |
1 |
NOC16H23 |
ABC16D23 |
-25.21 |
5.71 |
-9.06 |
-0.47 |
0 |
|
|
292949 |
117366143 |
1 |
NOC16H23 |
ABC16D23 |
-55.07 |
1.06 |
-8.43 |
0.47 |
0 |
|
|
292950 |
117366157 |
1 |
NOC16H23 |
ABC16D23 |
-43.72 |
2.59 |
-8.46 |
0.57 |
0 |
|
|
292951 |
117366162 |
1 |
NOC16H23 |
ABC16D23 |
-49.31 |
2.6 |
-8.39 |
0.49 |
0 |
|
|
292952 |
117366451 |
1 |
ClOF2N3H6C9 |
ABC2D3E6F9 |
-41.21 |
3.32 |
-9.86 |
-1.3 |
0 |
|
|
292953 |
117366831 |
1 |
ClFNOC12H17 |
ABCDE12F17 |
-94.04 |
2.19 |
-9.24 |
-0.34 |
0 |
|
|
292954 |
117366873 |
1 |
BrFNO2H5C8 |
ABCD2E5F8 |
-77.11 |
5.64 |
-9.43 |
-1.03 |
0 |
|
|
292955 |
117366879 |
1 |
BrFNO2H5C8 |
ABCD2E5F8 |
-85.25 |
2.21 |
-9.59 |
-0.91 |
0 |
|
|
292956 |
117366882 |
1 |
BrFNO2H5C8 |
ABCD2E5F8 |
-79.56 |
3.29 |
-9.55 |
-0.81 |
0 |
|
|
292957 |
117367061 |
1 |
BrFNC10H13 |
ABCD10E13 |
-45.39 |
1.55 |
-9.53 |
-0.27 |
0 |
|
|
292958 |
117367078 |
1 |
BrFNC10H13 |
ABCD10E13 |
-37.78 |
2.83 |
-9.48 |
-0.23 |
0 |
|
|
292959 |
117367082 |
1 |
BrFNC10H13 |
ABCD10E13 |
-40.89 |
3.78 |
-9.52 |
-0.34 |
0 |
|
|
292960 |
117367091 |
1 |
BrFNC10H13 |
ABCD10E13 |
-39.59 |
1.51 |
-9.44 |
-0.33 |
0 |
|
|
292961 |
117367108 |
1 |
NOCl2C11H13 |
ABC2D11E13 |
-22.18 |
2.77 |
-9.12 |
-0.57 |
0 |
|
|
292962 |
117367149 |
1 |
N2O5H6C11 |
A2B5C6D11 |
-68.82 |
9.59 |
-9.6 |
-2.64 |
0 |
|
|
292963 |
117367158 |
1 |
F3O3H9C11 |
A3B3C9D11 |
-252.92 |
7.14 |
-9.8 |
-0.97 |
0 |
|
|
292964 |
117367195 |
1 |
F2O4C11H12 |
A2B4C11D12 |
-246.52 |
2.56 |
-9.72 |
-0.64 |
0 |
|
|
292965 |
117367200 |
1 |
F2O4C11H12 |
A2B4C11D12 |
-263.21 |
2.29 |
-9.53 |
-0.68 |
0 |
|
|
292966 |
117367210 |
1 |
F2O4C11H12 |
A2B4C11D12 |
-240.4 |
3.45 |
-9.69 |
-0.87 |
0 |
|
|
292967 |
117367211 |
1 |
F2O4C11H12 |
A2B4C11D12 |
-243.55 |
1.09 |
-9.99 |
-0.94 |
0 |
|
|
292968 |
117367230 |
1 |
FSO5H7C9 |
ABC5D7E9 |
-213.08 |
6.06 |
-10.86 |
-1.98 |
0 |
|
|
292969 |
117367278 |
2 |
NO2H5C6 |
AB2C5D6 |
-112.04 |
5.97 |
-9.04 |
-1.63 |
0 |
|
|
292970 |
117367329 |
1 |
O2F3C12H13 |
A2B3C12D13 |
-248.68 |
6.33 |
-9.89 |
-0.29 |
0 |
|
|
292971 |
117367439 |
1 |
F2O3C12H16 |
A2B3C12D16 |
-221.05 |
5.33 |
-8.66 |
-0.17 |
0 |
|
|
292972 |
117367507 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-83.88 |
5.98 |
-9.4 |
-0.86 |
0 |
|
|
292973 |
117367512 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-92.53 |
4.2 |
-9.4 |
-0.87 |
0 |
|
|
292974 |
117367529 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-81.4 |
4.9 |
-9.31 |
-0.54 |
0 |