List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
91860 |
49979692 |
1 |
F3N5O5C33H40 |
A3B5C5D33E40 |
-346.76 |
9.46 |
-8.94 |
-0.28 |
0 |
|
|
91861 |
49979694 |
1 |
SO5N7C30H41 |
AB5C7D30E41 |
-165.35 |
6.11 |
-9.02 |
-0.79 |
0 |
|
|
91862 |
49979696 |
1 |
N5O6C34H43 |
A5B6C34D43 |
-227.2 |
8.68 |
-8.91 |
-0.83 |
0 |
|
|
91863 |
49979702 |
1 |
ClN6O6C40H47 |
AB6C6D40E47 |
-213.52 |
6.98 |
-8.67 |
-0.8 |
0 |
|
|
91864 |
49979703 |
1 |
ClN6O6C33H41 |
AB6C6D33E41 |
-229.33 |
7.33 |
-9.03 |
-0.89 |
0 |
|
|
91865 |
49979709 |
1 |
ClN6O6C37H47 |
AB6C6D37E47 |
-237.67 |
7.9 |
-9.04 |
-0.49 |
0 |
|
|
91866 |
49979714 |
1 |
ClN6O6C40H47 |
AB6C6D40E47 |
-218.61 |
5.68 |
-8.67 |
-0.87 |
0 |
|
|
91867 |
49979717 |
1 |
FN6O6C40H47 |
AB6C6D40E47 |
-257.77 |
7.18 |
-8.24 |
-0.56 |
0 |
|
|
91868 |
49979719 |
1 |
N6O7C41H50 |
A6B7C41D50 |
-248.39 |
11.11 |
-8.53 |
-0.55 |
0 |
|
|
91869 |
49979722 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-253.11 |
8.05 |
-8.18 |
-0.17 |
0 |
|
|
91870 |
49979737 |
1 |
ClN6O6C37H51 |
AB6C6D37E51 |
-266.19 |
6.42 |
-9.01 |
-0.93 |
0 |
|
|
91871 |
49979749 |
1 |
ClN6O6C39H47 |
AB6C6D39E47 |
-227.51 |
10.14 |
-8.82 |
-0.71 |
0 |
|
|
91872 |
49979754 |
1 |
N6O7C40H50 |
A6B7C40D50 |
-256.32 |
10.59 |
-8.6 |
-0.32 |
0 |
|
|
91873 |
49979774 |
1 |
N5O6C34H45 |
A5B6C34D45 |
-242.09 |
2.76 |
-9.1 |
-0.55 |
0 |
|
|
91874 |
49979775 |
1 |
N5O5C34H47 |
A5B5C34D47 |
-206.84 |
1.48 |
-9.24 |
-0.2 |
0 |
|
|
91875 |
49979780 |
1 |
FN5O5C33H44 |
AB5C5D33E44 |
-254.31 |
10.78 |
-8.64 |
-0.41 |
0 |
|
|
91876 |
49979785 |
1 |
FN5O5C32H42 |
AB5C5D32E42 |
-248.93 |
10.28 |
-8.86 |
-0.33 |
0 |
|
|
91877 |
49979792 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-242.91 |
11.77 |
-8.93 |
-0.72 |
0 |
|
|
91878 |
49979793 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-255.09 |
9.78 |
-8.79 |
-0.6 |
0 |
|
|
91879 |
49979812 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-241.0 |
5.58 |
-8.7 |
-0.24 |
0 |
|
|
91880 |
49979813 |
2 |
N3O3C18H25 |
A3B3C18D25 |
-258.88 |
1.27 |
-8.3 |
-0.25 |
0 |
|
|
91881 |
49979822 |
1 |
FN5O5C33H44 |
AB5C5D33E44 |
-250.38 |
9.05 |
-9.06 |
-0.38 |
0 |
|
|
91882 |
49979825 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-239.77 |
9.01 |
-9.04 |
-0.37 |
0 |
|
|
91883 |
49979829 |
2 |
N3O3C18H25 |
A3B3C18D25 |
-256.58 |
8.21 |
-8.95 |
-0.39 |
0 |
|
|
91884 |
49979837 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-254.7 |
5.74 |
-8.99 |
-0.35 |
0 |
|
|
91885 |
49979838 |
1 |
F2N6O6C39H46 |
A2B6C6D39E46 |
-302.74 |
7.06 |
-8.95 |
-0.92 |
0 |
|
|
91886 |
49979865 |
1 |
ClN6O6C37H43 |
AB6C6D37E43 |
-216.11 |
10.03 |
-8.88 |
-0.92 |
0 |
|
|
91887 |
49979870 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-257.58 |
11.69 |
-8.95 |
-0.42 |
0 |
|
|
91888 |
49979871 |
3 |
N2O2C13H18 |
A2B2C13D18 |
-264.98 |
9.51 |
-8.79 |
-0.24 |
0 |
|
|
91889 |
49979880 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-271.11 |
7.29 |
-9.06 |
-0.62 |
0 |
|
|
91890 |
49979883 |
1 |
F2N6O6C39H46 |
A2B6C6D39E46 |
-309.02 |
7.86 |
-9.0 |
-1.01 |
0 |
|
|
91891 |
49979884 |
1 |
FN6O6C39H47 |
AB6C6D39E47 |
-263.37 |
7.03 |
-8.91 |
-0.94 |
0 |
|
|
91892 |
49979887 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-250.34 |
4.74 |
-9.11 |
-0.61 |
0 |
|
|
91893 |
49979893 |
1 |
N6O7C36H50 |
A6B7C36D50 |
-291.8 |
8.52 |
-8.39 |
-0.25 |
0 |
|
|
91894 |
49979898 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-274.03 |
8.99 |
-8.68 |
-0.86 |
0 |
|
|
91895 |
49979911 |
1 |
FN6O7C38H45 |
AB6C7D38E45 |
-293.22 |
11.99 |
-8.6 |
-0.81 |
0 |
|
|
91896 |
49979916 |
1 |
F2N6O6C39H46 |
A2B6C6D39E46 |
-308.34 |
10.88 |
-9.03 |
-0.52 |
0 |
|
|
91897 |
49979917 |
3 |
N2O2C13H16 |
A2B2C13D16 |
-211.74 |
11.86 |
-8.87 |
-0.77 |
0 |
|
|
91898 |
49979943 |
1 |
N6O7C41H52 |
A6B7C41D52 |
-267.41 |
3.12 |
-8.39 |
-0.47 |
0 |
|
|
91900 |
49979968 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-251.63 |
4.58 |
-8.96 |
-0.41 |
0 |
|
|
91901 |
49979979 |
1 |
N6O7C38H54 |
A6B7C38D54 |
-297.94 |
9.92 |
-9.06 |
-0.37 |
0 |
|
|
91902 |
49979980 |
1 |
N6O7C38H52 |
A6B7C38D52 |
-277.09 |
8.43 |
-8.73 |
-0.23 |
0 |
|
|
91903 |
49979981 |
1 |
N6O7C39H54 |
A6B7C39D54 |
-288.15 |
15.08 |
-8.96 |
-0.51 |
0 |
|
|
91905 |
49979986 |
1 |
N6O7C41H58 |
A6B7C41D58 |
-309.34 |
2.53 |
-8.7 |
-0.23 |
0 |
|
|
91906 |
49979987 |
2 |
N3O3C20H28 |
A3B3C20D28 |
-269.57 |
5.97 |
-8.58 |
-0.15 |
0 |
|
|
91907 |
49979989 |
1 |
F2N6O6C39H46 |
A2B6C6D39E46 |
-305.64 |
9.71 |
-8.66 |
-0.66 |
0 |
|
|
91908 |
49980055 |
1 |
FN6O7C38H45 |
AB6C7D38E45 |
-287.0 |
8.99 |
-8.79 |
-0.46 |
0 |
|
|
91909 |
49980059 |
1 |
F2N6O6C39H46 |
A2B6C6D39E46 |
-307.91 |
8.8 |
-9.04 |
-0.68 |
0 |
|
|
91910 |
49980088 |
1 |
N6O7C36H48 |
A6B7C36D48 |
-272.83 |
11.91 |
-8.93 |
-0.73 |
0 |
|
|
91911 |
49980109 |
2 |
N3O3C20H28 |
A3B3C20D28 |
-274.82 |
9.75 |
-8.6 |
-0.4 |
0 |
|
|
91912 |
49980184 |
3 |
N2O2C13H18 |
A2B2C13D18 |
-260.55 |
11.5 |
-8.96 |
-0.41 |
0 |
|
|
91913 |
49980214 |
1 |
ClN6O6C38H51 |
AB6C6D38E51 |
-258.69 |
11.84 |
-9.16 |
-0.82 |
0 |
|
|
91914 |
49980227 |
1 |
FN6O6C39H47 |
AB6C6D39E47 |
-266.1 |
4.67 |
-8.76 |
-0.63 |
0 |
|
|
91915 |
49980231 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-264.8 |
3.79 |
-8.79 |
-0.61 |
0 |
|
|
91917 |
49980237 |
1 |
ClN6O6C38H45 |
AB6C6D38E45 |
-224.98 |
8.85 |
-9.06 |
-0.62 |
0 |
|
|
91918 |
49980241 |
1 |
ClN6O6C34H45 |
AB6C6D34E45 |
-251.07 |
5.25 |
-8.74 |
-0.56 |
0 |
|
|
91919 |
49980243 |
1 |
ClN6O6C32H41 |
AB6C6D32E41 |
-250.7 |
3.28 |
-8.81 |
-0.37 |
0 |
|
|
91920 |
49980251 |
1 |
FN6O6C41H51 |
AB6C6D41E51 |
-274.62 |
11.89 |
-8.95 |
-0.64 |
0 |
|
|
91921 |
49980253 |
2 |
FN3O3C20H24 |
AB3C3D20E24 |
-311.47 |
2.97 |
-8.94 |
-0.47 |
0 |
|
|
91922 |
49980255 |
1 |
FN6O6C41H51 |
AB6C6D41E51 |
-278.55 |
12.47 |
-9.02 |
-0.54 |
0 |
|
|
91923 |
49980272 |
1 |
FN6O6C39H47 |
AB6C6D39E47 |
-270.46 |
7.2 |
-8.96 |
-0.69 |
0 |
|
|
91924 |
49980323 |
1 |
ClN6O7C35H45 |
AB6C7D35E45 |
-275.33 |
2.55 |
-9.15 |
-0.94 |
0 |
|
|
91925 |
49980324 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-257.88 |
5.86 |
-9.02 |
-0.84 |
0 |
|
|
91926 |
49980358 |
1 |
N6O7C40H50 |
A6B7C40D50 |
-253.85 |
7.73 |
-8.33 |
-0.28 |
0 |
|
|
91927 |
49980382 |
1 |
N5O6C34H47 |
A5B6C34D47 |
-250.08 |
4.91 |
-8.19 |
-0.36 |
0 |
|
|
91928 |
49980396 |
2 |
FN3O3C20H24 |
AB3C3D20E24 |
-310.46 |
5.94 |
-9.02 |
-0.68 |
0 |
|
|
91929 |
49980398 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-271.64 |
5.98 |
-8.9 |
-0.5 |
0 |
|
|
91930 |
49980410 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-265.04 |
5.78 |
-8.93 |
-0.53 |
0 |
|
|
91931 |
49980486 |
1 |
FN5O5C32H42 |
AB5C5D32E42 |
-243.44 |
10.31 |
-9.0 |
-0.34 |
0 |
|
|
91932 |
49980521 |
1 |
O4N5C31H41 |
A4B5C31D41 |
-159.17 |
4.14 |
-8.92 |
-0.35 |
0 |
|
|
91933 |
49980551 |
1 |
ClO4N5C34H44 |
AB4C5D34E44 |
-178.54 |
3.86 |
-8.9 |
-0.74 |
0 |
|
|
91934 |
49980574 |
1 |
N5O6C31H39 |
A5B6C31D39 |
-224.65 |
6.54 |
-8.5 |
-0.25 |
0 |
|
|
91935 |
49980587 |
1 |
O4N5C36H43 |
A4B5C36D43 |
-141.2 |
12.84 |
-8.79 |
-0.72 |
0 |
|
|
91936 |
49980589 |
1 |
F2O4N5C35H39 |
A2B4C5D35E39 |
-221.48 |
6.86 |
-8.99 |
-0.8 |
0 |
|
|
91937 |
49980598 |
1 |
N5O5C29H37 |
A5B5C29D37 |
-193.17 |
5.4 |
-8.88 |
-0.55 |
0 |
|
|
91938 |
49980603 |
1 |
O4N5C29H37 |
A4B5C29D37 |
-151.84 |
6.51 |
-9.03 |
-0.56 |
0 |
|
|
91939 |
49980604 |
1 |
O4N5C31H41 |
A4B5C31D41 |
-158.61 |
4.41 |
-9.03 |
-0.36 |
0 |
|
|
91940 |
49980605 |
1 |
O4N5C30H39 |
A4B5C30D39 |
-154.93 |
4.38 |
-8.94 |
-0.46 |
0 |
|
|
91941 |
49980606 |
1 |
O4N5C31H41 |
A4B5C31D41 |
-169.11 |
7.49 |
-8.89 |
-0.39 |
0 |
|
|
91942 |
49980608 |
1 |
O4N5C33H43 |
A4B5C33D43 |
-164.04 |
3.84 |
-8.9 |
-0.3 |
0 |
|
|
91943 |
49980614 |
1 |
FO4N5C34H38 |
AB4C5D34E38 |
-173.63 |
9.17 |
-8.93 |
-0.73 |
0 |
|
|
91944 |
49980615 |
1 |
FO4N5C35H40 |
AB4C5D35E40 |
-180.17 |
9.39 |
-8.82 |
-0.6 |
0 |
|
|
91945 |
49980624 |
1 |
N5O5C32H41 |
A5B5C32D41 |
-191.65 |
9.28 |
-9.13 |
-0.7 |
0 |
|
|
91946 |
49980628 |
1 |
O4N5C31H41 |
A4B5C31D41 |
-163.84 |
8.74 |
-9.13 |
-0.38 |
0 |
|
|
91947 |
49980639 |
1 |
O4N5C31H41 |
A4B5C31D41 |
-167.93 |
3.63 |
-9.02 |
-0.54 |
0 |
|
|
91948 |
49980640 |
1 |
O4N5C32H43 |
A4B5C32D43 |
-170.57 |
6.43 |
-8.99 |
-0.38 |
0 |
|
|
91949 |
49980645 |
1 |
O4N5C33H45 |
A4B5C33D45 |
-175.71 |
6.58 |
-8.98 |
-0.16 |
0 |
|
|
91950 |
49980651 |
1 |
O4N5C35H47 |
A4B5C35D47 |
-183.24 |
8.85 |
-8.87 |
-0.48 |
0 |
|
|
91951 |
49980671 |
1 |
O4N5C32H41 |
A4B5C32D41 |
-156.54 |
10.87 |
-8.82 |
-0.51 |
0 |
|
|
91952 |
49980672 |
1 |
FO4N5C35H40 |
AB4C5D35E40 |
-180.95 |
10.14 |
-8.84 |
-0.8 |
0 |
|
|
91953 |
49980680 |
1 |
O4N5C34H45 |
A4B5C34D45 |
-176.24 |
3.35 |
-9.02 |
-0.39 |
0 |
|
|
91955 |
49980700 |
1 |
FO4N5C36H42 |
AB4C5D36E42 |
-185.35 |
5.16 |
-9.12 |
-0.59 |
0 |
|
|
91956 |
49980701 |
1 |
F2O4N5C35H39 |
A2B4C5D35E39 |
-220.88 |
6.29 |
-8.97 |
-0.75 |
0 |
|
|
91957 |
49980708 |
1 |
FO4N5C35H40 |
AB4C5D35E40 |
-177.02 |
12.91 |
-8.7 |
-0.73 |
0 |
|
|
91958 |
49980713 |
1 |
ClO4N5C32H40 |
AB4C5D32E40 |
-161.91 |
8.18 |
-9.12 |
-0.63 |
0 |
|
|
91959 |
49980716 |
1 |
FO4N5C35H40 |
AB4C5D35E40 |
-184.31 |
9.29 |
-8.82 |
-0.84 |
0 |
|
|
91960 |
49980717 |
1 |
F2O4N5C34H37 |
A2B4C5D34E37 |
-221.07 |
8.18 |
-8.84 |
-1.07 |
0 |
|
|
91961 |
49980743 |
1 |
BrO3N4C29H37 |
AB3C4D29E37 |
-131.39 |
8.06 |
-8.86 |
-0.28 |
0 |
|
|
91962 |
49980778 |
1 |
O3N4C30H40 |
A3B4C30D40 |
-125.17 |
4.63 |
-8.74 |
-0.21 |
0 |
|
|
91963 |
49980788 |
1 |
F3O3N4C28H33 |
A3B3C4D28E33 |
-269.84 |
2.71 |
-9.05 |
-0.74 |
0 |