List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
371892 |
131277721 |
1 |
SN3C11H11 |
AB3C11D11 |
61.37 |
7.0 |
-8.95 |
-0.99 |
0 |
|
|
371893 |
131277748 |
1 |
N2O2C9H12 |
A2B2C9D12 |
-15.23 |
3.13 |
-9.57 |
-0.55 |
0 |
|
|
371894 |
131277755 |
1 |
NO2C11H21 |
AB2C11D21 |
-75.95 |
4.07 |
-9.05 |
0.5 |
0 |
|
|
371895 |
131277880 |
1 |
NO2C12H15 |
AB2C12D15 |
-83.45 |
2.27 |
-8.39 |
0.38 |
0 |
|
|
371896 |
131277970 |
1 |
BrIO2H6C8 |
ABC2D6E8 |
-20.52 |
3.53 |
-9.4 |
-1.41 |
0 |
|
|
371897 |
131278026 |
1 |
SN2O3C5H12 |
AB2C3D5E12 |
-129.55 |
5.49 |
-9.53 |
0.32 |
0 |
|
|
371898 |
131278040 |
1 |
OF2N2C10H10 |
AB2C2D10E10 |
-82.22 |
6.11 |
-9.34 |
-0.51 |
0 |
|
|
371899 |
131278041 |
1 |
ON6C8H8 |
AB6C8D8 |
61.7 |
6.42 |
-9.61 |
-1.33 |
0 |
|
|
371900 |
131278042 |
1 |
ON2C12H16 |
AB2C12D16 |
-20.21 |
3.87 |
-8.38 |
-0.26 |
0 |
|
|
371901 |
131278101 |
1 |
BrClO2C8H8 |
ABC2D8E8 |
-69.38 |
0.97 |
-9.26 |
-0.43 |
0 |
|
|
371902 |
131278107 |
1 |
BrClO2C8H8 |
ABC2D8E8 |
-74.16 |
4.37 |
-9.07 |
-0.3 |
0 |
|
|
371903 |
131278416 |
1 |
FNCl2O2H4C10 |
ABC2D2E4F10 |
-82.51 |
5.6 |
-9.93 |
-2.17 |
0 |
|
|
371904 |
131278417 |
1 |
SN2C7H10 |
AB2C7D10 |
29.39 |
1.29 |
-7.59 |
0.64 |
0 |
|
|
371905 |
131278480 |
1 |
BrIO3H8C9 |
ABC3D8E9 |
-85.14 |
5.14 |
-9.2 |
-1.16 |
0 |
|
|
371906 |
131278727 |
1 |
BrFNO2C11H11 |
ABCD2E11F11 |
-82.09 |
3.72 |
-9.32 |
-0.85 |
0 |
|
|
371907 |
131278985 |
1 |
BrNF2C10H12 |
ABC2D10E12 |
-89.15 |
3.56 |
-9.43 |
-0.24 |
0 |
|
|
371908 |
131279142 |
1 |
Cl2N3C7H7 |
A2B3C7D7 |
50.04 |
3.03 |
-10.03 |
-1.19 |
0 |
|
|
371909 |
131279414 |
1 |
ON2C11H12 |
AB2C11D12 |
10.89 |
4.83 |
-8.99 |
-0.13 |
0 |
|
|
371910 |
131279415 |
1 |
ON2C11H12 |
AB2C11D12 |
9.94 |
3.65 |
-9.14 |
-0.3 |
0 |
|
|
371911 |
131279614 |
1 |
ON3C12H15 |
AB3C12D15 |
-21.34 |
3.53 |
-8.16 |
0.09 |
0 |
|
|
371912 |
131279618 |
1 |
BrN2O2C11H11 |
AB2C2D11E11 |
-49.75 |
5.13 |
-9.07 |
-0.69 |
0 |
|
|
371913 |
131279636 |
1 |
BrNOH12C13 |
ABCD12E13 |
8.37 |
1.76 |
-9.25 |
-0.68 |
0 |
|
|
371914 |
131279811 |
1 |
BrN2O3C9H9 |
AB2C3D9E9 |
-23.67 |
5.15 |
-9.64 |
-1.5 |
0 |
|
|
371915 |
131279812 |
1 |
ClN2O3C9H11 |
AB2C3D9E11 |
-41.61 |
3.43 |
-9.82 |
-1.8 |
0 |
|
|
371916 |
131279821 |
1 |
FIO2C8H8 |
ABC2D8E8 |
-94.72 |
3.48 |
-9.6 |
-1.26 |
0 |
|
|
371917 |
131279831 |
1 |
INF3H7C8 |
ABC3D7E8 |
-129.9 |
4.37 |
-8.79 |
-1.12 |
0 |
|
|
371918 |
131279832 |
1 |
O3F4H6C8 |
A3B4C6D8 |
-313.17 |
2.56 |
-9.81 |
-0.81 |
0 |
|
|
371919 |
131279965 |
1 |
O3H5N5C8 |
A3B5C5D8 |
22.41 |
3.89 |
-9.31 |
-1.32 |
0 |
|
|
371920 |
131279998 |
1 |
ON2C12H12 |
AB2C12D12 |
10.71 |
6.66 |
-8.25 |
-0.05 |
0 |
|
|
371921 |
131280004 |
1 |
N3C11H13 |
A3B11C13 |
48.63 |
4.97 |
-9.16 |
-0.92 |
0 |
|
|
371922 |
131280005 |
1 |
N3C11H13 |
A3B11C13 |
48.5 |
5.22 |
-9.1 |
-0.89 |
0 |
|
|
371923 |
131280008 |
1 |
ON2C12H12 |
AB2C12D12 |
25.62 |
2.38 |
-9.06 |
-0.35 |
0 |
|
|
371924 |
131280087 |
1 |
BrClFOH7C9 |
ABCDE7F9 |
-72.28 |
2.92 |
-9.99 |
-0.95 |
0 |
|
|
371925 |
131280193 |
1 |
INOF3H5C7 |
ABCD3E5F7 |
-172.97 |
4.43 |
-9.25 |
-1.19 |
0 |
|
|
371926 |
131280200 |
1 |
ION2H5C6 |
ABC2D5E6 |
17.9 |
3.32 |
-9.62 |
-1.45 |
0 |
|
|
371927 |
131280453 |
1 |
N3O3C9H13 |
A3B3C9D13 |
-89.18 |
2.99 |
-8.93 |
-0.06 |
0 |
|
|
371928 |
131280586 |
1 |
SO2F4H6C8 |
AB2C4D6E8 |
-268.1 |
1.46 |
-8.98 |
-1.23 |
0 |
|
|
371929 |
131280661 |
1 |
N2O3C10H12 |
A2B3C10D12 |
-37.7 |
5.89 |
-9.96 |
-1.32 |
0 |
|
|
371930 |
131280662 |
1 |
Cl2N2H10C11 |
A2B2C10D11 |
52.56 |
1.84 |
-9.69 |
-1.39 |
0 |
|
|
371931 |
131280671 |
2 |
NOC6H7 |
ABC6D7 |
-30.92 |
1.71 |
-8.95 |
-0.72 |
0 |
|
|
371932 |
131280750 |
1 |
ON3C8H11 |
AB3C8D11 |
-14.58 |
3.18 |
-7.87 |
0.95 |
0 |
|
|
371933 |
131280839 |
1 |
ClON4H7C10 |
ABC4D7E10 |
62.48 |
2.45 |
-9.96 |
-1.4 |
0 |
|
|
371934 |
131280884 |
1 |
OSN4C7H8 |
ABC4D7E8 |
20.91 |
2.9 |
-9.08 |
-1.16 |
0 |
|
|
371935 |
131280954 |
1 |
BrNOC8H8 |
ABCD8E8 |
-0.37 |
4.99 |
-9.98 |
-1.14 |
0 |
|
|
371936 |
131280989 |
1 |
ClSN2F3O4H6C7 |
ABC2D3E4F6G7 |
-296.32 |
2.26 |
-9.85 |
-1.48 |
0 |
|
|
371937 |
131281174 |
1 |
ClNSF2H4O4C9 |
ABCD2E4F4G9 |
-192.57 |
4.91 |
-11.2 |
-2.08 |
0 |
|
|
371938 |
131281375 |
1 |
BrN3C10H12 |
AB3C10D12 |
53.21 |
3.56 |
-9.14 |
-0.59 |
0 |
|
|
371939 |
131281540 |
1 |
NO5H7C8 |
AB5C7D8 |
-90.82 |
3.63 |
-9.9 |
-1.86 |
0 |
|
|
371940 |
131281547 |
1 |
BrON4C6H7 |
ABC4D6E7 |
28.26 |
5.57 |
-9.64 |
-1.2 |
0 |
|
|
371941 |
131281801 |
1 |
FIN2O2C10H12 |
ABC2D2E10F12 |
-89.18 |
2.94 |
-9.98 |
-1.74 |
0 |