List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
247950 |
103077711 |
1 |
BrClFN2O2S2C11H13 |
ABCD2E2F2G11H13 |
-108.44 |
4.39 |
-8.71 |
-1.4 |
0 |
|
|
247951 |
103077712 |
1 |
BrClFSN2O2C12H15 |
ABCDE2F2G12H15 |
-111.82 |
4.41 |
-9.26 |
-1.28 |
0 |
|
|
247952 |
103077733 |
1 |
BrClFN2O2S2C12H15 |
ABCD2E2F2G12H15 |
-117.85 |
4.57 |
-8.68 |
-1.4 |
0 |
|
|
247953 |
103077735 |
1 |
BrClFN2O2S2C12H17 |
ABCD2E2F2G12H17 |
-116.98 |
5.1 |
-8.47 |
-1.27 |
0 |
|
|
247954 |
103077741 |
1 |
BrClFSN2O4C11H13 |
ABCDE2F4G11H13 |
-189.77 |
4.49 |
-9.16 |
-1.2 |
0 |
|
|
247955 |
103077742 |
1 |
BrFSCl2O2N4H6C10 |
ABCD2E2F4G6H10 |
-50.75 |
5.92 |
-9.46 |
-1.74 |
0 |
|
|
247956 |
103077744 |
1 |
BrClFSN3O3C11H14 |
ABCDE3F3G11H14 |
-165.93 |
4.95 |
-9.19 |
-1.27 |
0 |
|
|
247957 |
103077745 |
1 |
BrClFSN3O3C10H12 |
ABCDE3F3G10H12 |
-161.04 |
4.94 |
-9.19 |
-1.27 |
0 |
|
|
247958 |
103077747 |
1 |
BrClFSO2N4C7H7 |
ABCDE2F4G7H7 |
-93.15 |
5.75 |
-9.18 |
-1.18 |
0 |
|
|
247959 |
103077759 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-137.9 |
2.48 |
-9.27 |
-1.32 |
0 |
|
|
247960 |
103077765 |
1 |
BrClFSN2O2C13H17 |
ABCDE2F2G13H17 |
-129.4 |
3.66 |
-9.18 |
-1.15 |
0 |
|
|
247961 |
103077770 |
1 |
BrClFSN2O3C12H17 |
ABCDE2F3G12H17 |
-167.93 |
5.31 |
-9.2 |
-1.18 |
0 |
|
|
247962 |
103077771 |
1 |
BrClFSN2O3C10H13 |
ABCDE2F3G10H13 |
-153.17 |
3.53 |
-9.24 |
-1.26 |
0 |
|
|
247963 |
103077775 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-166.84 |
6.18 |
-9.38 |
-1.43 |
0 |
|
|
247964 |
103077777 |
1 |
BrClFN2O2S2C10H11 |
ABCD2E2F2G10H11 |
-108.28 |
4.43 |
-8.72 |
-1.4 |
0 |
|
|
247965 |
103077779 |
1 |
O2N3C13H27 |
A2B3C13D27 |
-109.13 |
3.89 |
-8.9 |
1.28 |
0 |
|
|
247966 |
103077792 |
1 |
N4C13H16 |
A4B13C16 |
65.78 |
2.44 |
-8.04 |
0.63 |
0 |
|
|
247967 |
103077794 |
1 |
N5C10H19 |
A5B10C19 |
40.56 |
2.44 |
-7.86 |
0.82 |
0 |
|
|
247968 |
103077810 |
2 |
N2C8H9 |
A2B8C9 |
86.43 |
2.48 |
-7.89 |
-0.34 |
0 |
|
|
247969 |
103077812 |
1 |
ClN5C14H18 |
AB5C14D18 |
67.67 |
6.05 |
-8.21 |
0.21 |
0 |
|
|
247970 |
103077818 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-9.37 |
4.11 |
-7.93 |
0.43 |
0 |
|
|
247971 |
103077821 |
1 |
N5C15H21 |
A5B15C21 |
73.94 |
2.1 |
-8.0 |
0.45 |
0 |
|
|
247972 |
103077846 |
2 |
N2C8H13 |
A2B8C13 |
9.43 |
2.2 |
-7.73 |
0.87 |
0 |
|
|
247973 |
103077862 |
1 |
N5C15H23 |
A5B15C23 |
68.72 |
1.22 |
-7.71 |
0.46 |
0 |
|
|
247974 |
103077872 |
1 |
N4C11H20 |
A4B11C20 |
19.5 |
2.03 |
-7.69 |
0.91 |
0 |
|
|
247975 |
103077876 |
1 |
ON5C10H19 |
AB5C10D19 |
6.42 |
3.59 |
-7.94 |
0.74 |
0 |
|
|
247976 |
103077877 |
1 |
N5C10H13 |
A5B10C13 |
80.57 |
3.23 |
-7.93 |
-0.03 |
0 |
|
|
247977 |
103077898 |
2 |
ClN2C5H5 |
AB2C5D5 |
53.04 |
3.7 |
-8.57 |
-0.26 |
0 |
|
|
247978 |
103077902 |
4 |
NC4H4 |
AB4C4 |
97.38 |
3.49 |
-7.86 |
0.22 |
0 |
|
|
247979 |
103077905 |
2 |
N2C7H11 |
A2B7C11 |
17.54 |
2.04 |
-7.69 |
0.92 |
0 |
|
|
247980 |
103077907 |
1 |
ON4C12H16 |
AB4C12D16 |
30.52 |
3.54 |
-7.59 |
0.32 |
0 |
|
|
247981 |
103077913 |
1 |
ON4C16H16 |
AB4C16D16 |
66.3 |
4.74 |
-7.81 |
0.12 |
0 |
|
|
247982 |
103077938 |
1 |
OF3N4C11H11 |
AB3C4D11E11 |
-131.31 |
7.49 |
-8.13 |
-0.26 |
0 |
|
|
247983 |
103077940 |
1 |
OF3N4C11H11 |
AB3C4D11E11 |
-130.06 |
5.43 |
-8.09 |
-0.28 |
0 |
|
|
247984 |
103077945 |
1 |
ClF3N4H10C11 |
AB3C4D10E11 |
-95.8 |
5.5 |
-8.1 |
-0.67 |
0 |
|
|
247985 |
103077946 |
1 |
IN4C10H11 |
AB4C10D11 |
88.96 |
5.89 |
-8.01 |
-0.48 |
0 |
|
|
247986 |
103077949 |
2 |
ON2C6H7 |
AB2C6D7 |
0.4 |
2.49 |
-7.68 |
0.32 |
0 |
|
|
247987 |
103077954 |
1 |
FN4C10H11 |
AB4C10D11 |
22.56 |
4.96 |
-8.42 |
0.13 |
0 |
|
|
247988 |
103077960 |
1 |
BrN4C10H11 |
AB4C10D11 |
73.41 |
5.11 |
-8.46 |
-0.02 |
0 |
|
|
247989 |
103077980 |
1 |
FN4C11H13 |
AB4C11D13 |
17.64 |
4.33 |
-8.26 |
0.15 |
0 |
|
|
247990 |
103077990 |
1 |
ClFN4C10H10 |
ABC4D10E10 |
19.06 |
6.01 |
-8.28 |
-0.1 |
0 |
|
|
247991 |
103077999 |
1 |
N4C11H20 |
A4B11C20 |
23.07 |
1.92 |
-7.76 |
0.88 |
0 |
|
|
247992 |
103078000 |
2 |
N2C8H11 |
A2B8C11 |
53.75 |
2.42 |
-7.95 |
0.5 |
0 |
|
|
247993 |
103078002 |
1 |
ON5C11H21 |
AB5C11D21 |
0.84 |
2.47 |
-7.75 |
0.89 |
0 |
|
|
247994 |
103078014 |
1 |
N4C9H18 |
A4B9C18 |
27.13 |
1.87 |
-7.84 |
0.9 |
0 |
|
|
247995 |
103078017 |
2 |
N2C5H10 |
A2B5C10 |
25.18 |
2.02 |
-7.94 |
0.86 |
0 |
|
|
247996 |
103078032 |
1 |
N4C13H18 |
A4B13C18 |
55.32 |
3.19 |
-7.7 |
0.53 |
0 |
|
|
247997 |
103078048 |
1 |
N4C9H16 |
A4B9C16 |
51.87 |
2.26 |
-7.75 |
0.88 |
0 |
|
|
247998 |
103078060 |
1 |
O2N4C13H18 |
A2B4C13D18 |
-2.82 |
2.56 |
-7.78 |
0.28 |
0 |
|
|
247999 |
103078068 |
1 |
ON5C9H17 |
AB5C9D17 |
-9.3 |
6.6 |
-8.13 |
0.56 |
0 |