List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
334865 |
127253671 |
1 |
ClN2O6C24H31 |
AB2C6D24E31 |
-221.78 |
8.13 |
-8.97 |
-0.46 |
0 |
|
|
334866 |
127253672 |
1 |
NO8H23C26 |
AB8C23D26 |
-279.37 |
6.3 |
-9.28 |
-1.46 |
0 |
|
|
334867 |
127253673 |
1 |
N3O7C33H39 |
A3B7C33D39 |
-206.94 |
5.41 |
-8.24 |
-0.6 |
0 |
|
|
334868 |
127253674 |
2 |
O2N3C16H17 |
A2B3C16D17 |
-5.71 |
9.83 |
-8.85 |
-1.35 |
0 |
|
|
334869 |
127253675 |
1 |
NO7C27H27 |
AB7C27D27 |
-193.15 |
4.12 |
-8.64 |
-0.77 |
0 |
|
|
334870 |
127253676 |
1 |
ClN3O7C33H34 |
AB3C7D33E34 |
-222.63 |
4.14 |
-9.09 |
-0.94 |
0 |
|
|
334871 |
127253677 |
1 |
N3O6C23H27 |
A3B6C23D27 |
-192.22 |
3.22 |
-8.1 |
-0.42 |
0 |
|
|
334872 |
127253678 |
1 |
N5O6C37H45 |
A5B6C37D45 |
-155.67 |
6.66 |
-8.71 |
-0.62 |
0 |
|
|
334873 |
127253679 |
1 |
O7H22C27 |
A7B22C27 |
-168.76 |
5.89 |
-8.5 |
-1.32 |
0 |
|
|
334874 |
127253680 |
1 |
N5O6C36H41 |
A5B6C36D41 |
-144.84 |
9.22 |
-8.01 |
-0.39 |
0 |
|
|
334875 |
127253681 |
1 |
ClN2O6C27H31 |
AB2C6D27E31 |
-181.39 |
4.64 |
-8.81 |
-0.36 |
0 |
|
|
334876 |
127253682 |
1 |
N3O6H17C19 |
A3B6C17D19 |
-109.65 |
11.44 |
-9.2 |
-1.32 |
0 |
|
|
334877 |
127253683 |
1 |
N5O6C36H43 |
A5B6C36D43 |
-159.41 |
5.52 |
-8.76 |
-0.73 |
0 |
|
|
334878 |
127253684 |
2 |
N2O3C14H16 |
A2B3C14D16 |
-204.47 |
4.83 |
-8.58 |
-0.18 |
0 |
|
|
334879 |
127253685 |
1 |
ClN3O5C28H30 |
AB3C5D28E30 |
-137.11 |
4.64 |
-8.85 |
-0.47 |
0 |
|
|
334880 |
127253686 |
1 |
N3O4C27H27 |
A3B4C27D27 |
-75.74 |
5.08 |
-8.06 |
-0.61 |
0 |
|
|
334881 |
127253687 |
1 |
N6O7C34H38 |
A6B7C34D38 |
-150.02 |
3.32 |
-8.68 |
-0.71 |
0 |
|
|
334882 |
127253688 |
1 |
ClSN2O7C23H29 |
ABC2D7E23F29 |
-265.43 |
9.13 |
-8.75 |
-0.38 |
0 |
|
|
334883 |
127253689 |
1 |
NO5H23C27 |
AB5C23D27 |
-98.79 |
3.61 |
-8.32 |
-1.42 |
0 |
|
|
334884 |
127253690 |
1 |
N3O4H19C23 |
A3B4C19D23 |
35.52 |
5.36 |
-7.48 |
-1.73 |
0 |
|
|
334885 |
127253691 |
1 |
O4N5H29C31 |
A4B5C29D31 |
-9.08 |
10.22 |
-8.62 |
-1.33 |
0 |
|
|
334886 |
127253692 |
1 |
SN5O7C38H45 |
AB5C7D38E45 |
-161.04 |
5.85 |
-8.75 |
-0.97 |
0 |
|
|
334887 |
127253693 |
1 |
ClNO7H22C26 |
ABC7D22E26 |
-213.35 |
9.94 |
-8.9 |
-1.08 |
0 |
|
|
334888 |
127253694 |
1 |
N3O6C32H37 |
A3B6C32D37 |
-165.12 |
9.54 |
-8.11 |
-0.52 |
0 |
|
|
334889 |
127253695 |
1 |
NO6C24H25 |
AB6C24D25 |
-180.4 |
5.49 |
-8.28 |
-1.43 |
0 |
|
|
334890 |
127253696 |
1 |
N5O6C31H39 |
A5B6C31D39 |
-119.82 |
6.41 |
-8.53 |
-0.85 |
0 |
|
|
334891 |
127253697 |
1 |
BrClN2O5H20C25 |
ABC2D5E20F25 |
-107.56 |
5.0 |
-8.78 |
-1.26 |
0 |
|
|
334892 |
127253698 |
1 |
N3O4H21C27 |
A3B4C21D27 |
-31.65 |
4.61 |
-8.51 |
-1.52 |
0 |
|
|
334893 |
127253699 |
1 |
O7H14C20 |
A7B14C20 |
-215.39 |
4.94 |
-8.4 |
-0.68 |
0 |
|
|
334894 |
127253700 |
1 |
ClN3O5H24C25 |
AB3C5D24E25 |
-123.72 |
1.77 |
-8.71 |
-0.44 |
0 |
|
|
334895 |
127253701 |
1 |
N3O8C35H43 |
A3B8C35D43 |
-257.64 |
9.21 |
-8.28 |
-0.68 |
0 |
|
|
334896 |
127253702 |
2 |
NO2H7C9 |
AB2C7D9 |
-54.74 |
4.27 |
-8.3 |
-1.49 |
0 |
|
|
334897 |
127253703 |
2 |
NO2H9C12 |
AB2C9D12 |
-41.56 |
4.33 |
-8.3 |
-1.43 |
0 |
|
|
334898 |
127253704 |
1 |
N5O7C37H43 |
A5B7C37D43 |
-144.98 |
5.26 |
-8.56 |
-0.69 |
0 |
|
|
334899 |
127253705 |
1 |
ClNO7C20H24 |
ABC7D20E24 |
-257.93 |
3.91 |
-8.82 |
-0.46 |
0 |
|
|
334900 |
127253706 |
1 |
N5O8C26H29 |
A5B8C26D29 |
-210.0 |
12.45 |
-8.22 |
-1.57 |
0 |
|
|
334901 |
127253707 |
1 |
N4O5C24H32 |
A4B5C24D32 |
-185.32 |
7.06 |
-8.74 |
-0.2 |
0 |
|
|
334902 |
127253708 |
1 |
N5O7C33H43 |
A5B7C33D43 |
-63.54 |
3.96 |
-8.26 |
-0.91 |
0 |
|
|
334903 |
127253709 |
1 |
N3O8C25H29 |
A3B8C25D29 |
-282.29 |
3.01 |
-8.5 |
-0.3 |
0 |
|
|
334904 |
127253710 |
1 |
ClN5O8H30C32 |
AB5C8D30E32 |
-246.42 |
8.07 |
-8.26 |
-1.06 |
0 |
|
|
334905 |
127253711 |
2 |
NO2C15H18 |
AB2C15D18 |
-143.45 |
2.91 |
-8.73 |
-0.88 |
0 |
|
|
334906 |
127253712 |
1 |
SN5O7C40H45 |
AB5C7D40E45 |
-166.85 |
5.44 |
-7.89 |
-0.64 |
0 |
|
|
334907 |
127253713 |
1 |
ClN2O6C23H29 |
AB2C6D23E29 |
-215.18 |
3.75 |
-8.84 |
-0.46 |
0 |
|
|
334908 |
127253714 |
1 |
ClNO8H30C33 |
ABC8D30E33 |
-245.73 |
3.45 |
-8.1 |
-0.66 |
0 |
|
|
334909 |
127253715 |
1 |
NO5C24H25 |
AB5C24D25 |
-122.18 |
4.97 |
-9.07 |
-1.06 |
0 |
|
|
334910 |
127253716 |
1 |
N3O6C29H35 |
A3B6C29D35 |
-179.92 |
5.04 |
-8.35 |
-0.55 |
0 |
|
|
334911 |
127253717 |
1 |
O24C49H78 |
A24B49C78 |
-1117.1 |
3.83 |
-9.81 |
0.13 |
0 |
|
|
334912 |
127253718 |
1 |
ClSN3O6H26C27 |
ABC3D6E26F27 |
-140.35 |
8.64 |
-8.59 |
-0.74 |
0 |
|
|
334913 |
127253719 |
1 |
NO5H21C27 |
AB5C21D27 |
-88.83 |
5.76 |
-8.23 |
-1.43 |
0 |
|
|
334914 |
127253720 |
1 |
SN2O4C24H28 |
AB2C4D24E28 |
-115.47 |
2.25 |
-8.22 |
-0.6 |
0 |
|
|
334915 |
127253721 |
1 |
N3O4H27C30 |
A3B4C27D30 |
-45.46 |
5.16 |
-8.37 |
-1.66 |
0 |
|
|
334916 |
127253722 |
1 |
N2O7C30H32 |
A2B7C30D32 |
-220.56 |
5.4 |
-7.89 |
-0.43 |
0 |
|
|
334917 |
127253723 |
1 |
ClN5O5H18C21 |
AB5C5D18E21 |
-64.4 |
2.13 |
-9.03 |
-1.11 |
0 |
|
|
334918 |
127253724 |
2 |
N2O3C19H23 |
A2B3C19D23 |
-158.06 |
4.25 |
-8.44 |
-0.52 |
0 |
|
|
334919 |
127253725 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-41.99 |
6.4 |
-8.1 |
-0.25 |
0 |
|
|
334920 |
127253726 |
1 |
N3O6C31H39 |
A3B6C31D39 |
-194.2 |
5.36 |
-8.35 |
-0.68 |
0 |
|
|
334921 |
127253727 |
2 |
ON2C13H13 |
AB2C13D13 |
-12.15 |
2.26 |
-9.27 |
-1.16 |
0 |
|
|
334922 |
127253728 |
1 |
ClSN4O8H27C34 |
ABC4D8E27F34 |
-192.04 |
8.61 |
-8.86 |
-1.11 |
0 |
|
|
334923 |
127253729 |
1 |
N6O7C36H42 |
A6B7C36D42 |
-135.6 |
5.09 |
-8.54 |
-0.98 |
0 |
|
|
334924 |
127253730 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-101.84 |
4.66 |
-8.41 |
-0.22 |
0 |
|
|
334925 |
127253731 |
1 |
N6O7C36H42 |
A6B7C36D42 |
-108.31 |
7.19 |
-8.35 |
-0.97 |
0 |
|
|
334926 |
127253732 |
1 |
ClN3O7H22C26 |
AB3C7D22E26 |
-173.01 |
3.53 |
-9.02 |
-1.56 |
0 |
|
|
334927 |
127253733 |
1 |
N2O7H22C23 |
A2B7C22D23 |
-191.34 |
4.37 |
-8.83 |
-0.8 |
0 |
|
|
334928 |
127253734 |
1 |
N3O3H21C22 |
A3B3C21D22 |
-49.99 |
3.98 |
-9.32 |
-1.27 |
0 |
|
|
334929 |
127253735 |
1 |
ClN3O5C21H22 |
AB3C5D21E22 |
-121.0 |
4.85 |
-8.96 |
-0.49 |
0 |
|
|
334930 |
127253736 |
1 |
ClO5N6H25C28 |
AB5C6D25E28 |
-48.94 |
5.33 |
-8.78 |
-0.74 |
0 |
|
|
334931 |
127253737 |
1 |
ClN5O7C26H26 |
AB5C7D26E26 |
-144.77 |
5.92 |
-8.75 |
-0.86 |
0 |
|
|
334932 |
127253738 |
1 |
ClNO8C24H24 |
ABC8D24E24 |
-273.62 |
3.99 |
-8.85 |
-0.5 |
0 |
|
|
334933 |
127253739 |
1 |
N3O4C28H35 |
A3B4C28D35 |
-72.48 |
3.53 |
-8.25 |
0.09 |
0 |
|
|
334934 |
127253740 |
1 |
O6N7C36H39 |
A6B7C36D39 |
-89.11 |
4.95 |
-8.33 |
-0.29 |
0 |
|
|
334935 |
127253741 |
1 |
N3O3C24H35 |
A3B3C24D35 |
-99.78 |
3.35 |
-8.2 |
0.23 |
0 |
|
|
334936 |
127253742 |
6 |
OH3C4 |
AB3C4 |
-134.05 |
6.16 |
-8.86 |
-1.43 |
0 |
|
|
334937 |
127253743 |
1 |
SN4O8C35H36 |
AB4C8D35E36 |
-193.6 |
8.97 |
-8.73 |
-1.02 |
0 |
|
|
334938 |
127253744 |
1 |
O7H14C26 |
A7B14C26 |
-159.77 |
5.69 |
-8.59 |
-1.33 |
0 |
|
|
334939 |
127253745 |
1 |
N3O5H15C16 |
A3B5C15D16 |
-73.49 |
11.43 |
-9.6 |
-1.24 |
0 |