List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
247900 |
103077375 |
1 |
BrClFO2S2N3H10C11 |
ABCD2E2F3G10H11 |
-71.78 |
4.69 |
-9.29 |
-1.34 |
0 |
|
|
247901 |
103077377 |
1 |
BrClFSN2O3C10H13 |
ABCDE2F3G10H13 |
-146.41 |
5.89 |
-9.27 |
-1.26 |
0 |
|
|
247902 |
103077378 |
1 |
BrClFSN2O2C12H17 |
ABCDE2F2G12H17 |
-130.85 |
4.15 |
-9.24 |
-1.26 |
0 |
|
|
247903 |
103077383 |
1 |
BrClFSN2O3C12H17 |
ABCDE2F3G12H17 |
-158.24 |
3.58 |
-9.17 |
-1.2 |
0 |
|
|
247904 |
103077389 |
1 |
BrClFO2S2N3H10C11 |
ABCD2E2F3G10H11 |
-73.08 |
4.78 |
-9.27 |
-1.28 |
0 |
|
|
247905 |
103077408 |
1 |
BrClFN2O2S2H11C12 |
ABCD2E2F2G11H12 |
-75.47 |
4.93 |
-9.09 |
-1.31 |
0 |
|
|
247906 |
103077409 |
1 |
BrClFSN2O2C13H15 |
ABCDE2F2G13H15 |
-73.62 |
4.34 |
-9.26 |
-1.27 |
0 |
|
|
247907 |
103077424 |
1 |
BrClFSO2N4H9C10 |
ABCDE2F4G9H10 |
-53.42 |
7.12 |
-9.51 |
-1.62 |
0 |
|
|
247908 |
103077449 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-168.88 |
5.35 |
-9.27 |
-1.28 |
0 |
|
|
247909 |
103077453 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-164.17 |
4.35 |
-9.31 |
-1.38 |
0 |
|
|
247910 |
103077455 |
1 |
BrClFSO2N3C11H16 |
ABCDE2F3G11H16 |
-106.43 |
6.03 |
-8.88 |
-1.3 |
0 |
|
|
247911 |
103077464 |
1 |
BrClFSN2O2C13H17 |
ABCDE2F2G13H17 |
-129.87 |
3.71 |
-9.21 |
-1.22 |
0 |
|
|
247912 |
103077467 |
1 |
BrClFSO2N3C12H16 |
ABCDE2F3G12H16 |
-81.93 |
4.36 |
-9.05 |
-1.25 |
0 |
|
|
247913 |
103077470 |
1 |
BrClFSN3O3C11H12 |
ABCDE3F3G11H12 |
-136.92 |
6.69 |
-9.5 |
-1.61 |
0 |
|
|
247914 |
103077471 |
1 |
BrClFSO2N3C12H16 |
ABCDE2F3G12H16 |
-102.84 |
2.2 |
-8.95 |
-1.21 |
0 |
|
|
247915 |
103077472 |
1 |
BrClFSN2O2C12H15 |
ABCDE2F2G12H15 |
-124.82 |
6.13 |
-9.18 |
-1.19 |
0 |
|
|
247916 |
103077477 |
1 |
BrClFSN2O2C12H15 |
ABCDE2F2G12H15 |
-122.53 |
3.83 |
-9.24 |
-1.25 |
0 |
|
|
247917 |
103077479 |
1 |
BrClFSO2N4C11H11 |
ABCDE2F4G11H11 |
-67.89 |
7.96 |
-9.33 |
-1.45 |
0 |
|
|
247918 |
103077491 |
1 |
BrClFSN2O3C12H17 |
ABCDE2F3G12H17 |
-158.82 |
3.46 |
-9.31 |
-1.33 |
0 |
|
|
247919 |
103077499 |
1 |
BrClFSN2O2C13H19 |
ABCDE2F2G13H19 |
-132.88 |
4.16 |
-9.19 |
-1.2 |
0 |
|
|
247920 |
103077512 |
1 |
BrClFSN2O2C13H17 |
ABCDE2F2G13H17 |
-124.03 |
5.27 |
-9.28 |
-1.27 |
0 |
|
|
247921 |
103077521 |
1 |
BrClFSN3O3C11H12 |
ABCDE3F3G11H12 |
-150.3 |
6.94 |
-9.4 |
-1.44 |
0 |
|
|
247922 |
103077535 |
1 |
BrClFSN2O3C10H13 |
ABCDE2F3G10H13 |
-164.23 |
3.76 |
-9.32 |
-1.35 |
0 |
|
|
247923 |
103077556 |
1 |
BrClFSO2N4H9C10 |
ABCDE2F4G9H10 |
-72.3 |
7.1 |
-9.36 |
-1.54 |
0 |
|
|
247924 |
103077559 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-163.53 |
6.08 |
-9.31 |
-1.32 |
0 |
|
|
247925 |
103077571 |
1 |
BrClFSO2N3H10C12 |
ABCDE2F3G10H12 |
-74.04 |
5.76 |
-9.36 |
-1.46 |
0 |
|
|
247926 |
103077574 |
1 |
BrClFSN2O2C13H17 |
ABCDE2F2G13H17 |
-109.63 |
6.06 |
-9.19 |
-1.23 |
0 |
|
|
247927 |
103077584 |
1 |
BrClFN2O2S2H11C12 |
ABCD2E2F2G11H12 |
-79.79 |
4.61 |
-8.93 |
-1.35 |
0 |
|
|
247928 |
103077588 |
1 |
BrClFN2O2S2C11H13 |
ABCD2E2F2G11H13 |
-113.53 |
3.74 |
-8.77 |
-1.27 |
0 |
|
|
247929 |
103077589 |
1 |
BrClFN2O2S2C12H15 |
ABCD2E2F2G12H15 |
-117.35 |
5.54 |
-8.76 |
-1.26 |
0 |
|
|
247930 |
103077591 |
1 |
BrClFSN2O3C12H13 |
ABCDE2F3G12H13 |
-142.87 |
4.88 |
-9.28 |
-1.32 |
0 |
|
|
247931 |
103077593 |
1 |
BrClFSN2O3C11H15 |
ABCDE2F3G11H15 |
-153.7 |
5.59 |
-9.29 |
-1.29 |
0 |
|
|
247932 |
103077611 |
1 |
BrClFSN2O2C11H13 |
ABCDE2F2G11H13 |
-93.8 |
5.95 |
-9.22 |
-1.25 |
0 |
|
|
247933 |
103077613 |
1 |
BrClFSN2O2C12H13 |
ABCDE2F2G12H13 |
-66.21 |
5.78 |
-9.26 |
-1.3 |
0 |
|
|
247934 |
103077622 |
1 |
BrClFSO2N4C11H11 |
ABCDE2F4G11H11 |
-58.12 |
5.71 |
-9.18 |
-1.19 |
0 |
|
|
247935 |
103077634 |
1 |
BrClFSN3O4C9H10 |
ABCDE3F4G9H10 |
-193.18 |
5.59 |
-9.32 |
-1.38 |
0 |
|
|
247936 |
103077637 |
1 |
BrClFSN2O3C12H15 |
ABCDE2F3G12H15 |
-163.69 |
3.44 |
-9.21 |
-1.26 |
0 |
|
|
247937 |
103077641 |
1 |
BrClFSN2O3C9H9 |
ABCDE2F3G9H9 |
-111.05 |
3.68 |
-9.24 |
-1.29 |
0 |
|
|
247938 |
103077644 |
1 |
BrClFSN3O3C11H14 |
ABCDE3F3G11H14 |
-158.07 |
7.59 |
-9.29 |
-1.32 |
0 |
|
|
247939 |
103077649 |
1 |
BrClFSN2O3C10H13 |
ABCDE2F3G10H13 |
-159.33 |
4.01 |
-9.33 |
-1.38 |
0 |
|
|
247940 |
103077651 |
1 |
BrClFSO2N4C11H11 |
ABCDE2F4G11H11 |
-71.97 |
7.4 |
-9.15 |
-1.27 |
0 |
|
|
247941 |
103077652 |
1 |
BrClFSO2N4H9C10 |
ABCDE2F4G9H10 |
-63.47 |
5.69 |
-9.42 |
-1.54 |
0 |
|
|
247942 |
103077655 |
1 |
BrClFSN2O3C11H15 |
ABCDE2F3G11H15 |
-161.82 |
3.35 |
-9.24 |
-1.25 |
0 |
|
|
247943 |
103077661 |
1 |
BrClFN2O2S2C10H13 |
ABCD2E2F2G10H13 |
-114.1 |
4.06 |
-8.62 |
-1.26 |
0 |
|
|
247944 |
103077663 |
1 |
BrClFSN2O2C11H13 |
ABCDE2F2G11H13 |
-108.05 |
4.22 |
-9.27 |
-1.27 |
0 |
|
|
247945 |
103077691 |
1 |
BrClFN2S2O3C11H15 |
ABCD2E2F3G11H15 |
-141.04 |
2.82 |
-8.49 |
-1.4 |
0 |
|
|
247946 |
103077696 |
1 |
BrClFN2O2S2C11H15 |
ABCD2E2F2G11H15 |
-116.86 |
3.62 |
-8.7 |
-1.26 |
0 |
|
|
247947 |
103077701 |
1 |
BrClFSN2O3C11H15 |
ABCDE2F3G11H15 |
-167.33 |
2.62 |
-9.17 |
-1.22 |
0 |
|
|
247948 |
103077703 |
1 |
BrClFN2O2S2C11H15 |
ABCD2E2F2G11H15 |
-117.28 |
5.7 |
-8.74 |
-1.28 |
0 |
|
|
247949 |
103077707 |
1 |
BrClFSN3O3C10H12 |
ABCDE3F3G10H12 |
-160.12 |
6.34 |
-9.25 |
-1.29 |
0 |
|
|
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 |