List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
104657 |
50104834 |
2 |
N3O3C18H25 |
A3B3C18D25 |
-252.9 |
6.66 |
-8.85 |
-0.41 |
0 |
|
|
104658 |
50104836 |
2 |
N3O3C15H20 |
A3B3C15D20 |
-225.88 |
7.85 |
-8.8 |
-0.38 |
0 |
|
|
104659 |
50104837 |
1 |
N6O6C33H46 |
A6B6C33D46 |
-239.81 |
5.89 |
-8.78 |
-0.39 |
0 |
|
|
104660 |
50104838 |
1 |
N6O6C35H42 |
A6B6C35D42 |
-198.36 |
5.8 |
-8.84 |
-0.83 |
0 |
|
|
104661 |
50104839 |
1 |
FN6O6C35H41 |
AB6C6D35E41 |
-246.3 |
5.42 |
-8.86 |
-0.78 |
0 |
|
|
104662 |
50104840 |
2 |
N3O3C18H22 |
A3B3C18D22 |
-199.84 |
10.41 |
-8.68 |
-0.49 |
0 |
|
|
104663 |
50104841 |
1 |
O5N6C35H42 |
A5B6C35D42 |
-173.02 |
10.67 |
-8.78 |
-0.45 |
0 |
|
|
104664 |
50104845 |
1 |
O5N6C34H40 |
A5B6C34D40 |
-164.51 |
6.16 |
-8.56 |
-0.63 |
0 |
|
|
104665 |
50104847 |
1 |
FO5N6C34H39 |
AB5C6D34E39 |
-206.11 |
8.8 |
-8.76 |
-0.86 |
0 |
|
|
104666 |
50104850 |
1 |
ClO5N6C34H39 |
AB5C6D34E39 |
-166.96 |
8.31 |
-8.72 |
-0.8 |
0 |
|
|
104667 |
50104851 |
1 |
O5N6C31H42 |
A5B6C31D42 |
-201.42 |
3.91 |
-8.72 |
-0.28 |
0 |
|
|
104668 |
50104855 |
1 |
O5N6C33H46 |
A5B6C33D46 |
-208.71 |
6.81 |
-9.08 |
-0.46 |
0 |
|
|
104669 |
50104856 |
1 |
O5N6C34H48 |
A5B6C34D48 |
-216.79 |
7.44 |
-8.79 |
-0.26 |
0 |
|
|
104670 |
50104858 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-206.31 |
3.25 |
-8.88 |
-0.29 |
0 |
|
|
104671 |
50104862 |
1 |
O5N6C30H40 |
A5B6C30D40 |
-197.73 |
6.27 |
-8.83 |
-0.46 |
0 |
|
|
104672 |
50104863 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-216.85 |
3.25 |
-8.83 |
-0.45 |
0 |
|
|
104673 |
50104865 |
1 |
O5N6C34H48 |
A5B6C34D48 |
-216.62 |
5.06 |
-8.99 |
-0.45 |
0 |
|
|
104674 |
50104866 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-202.88 |
5.93 |
-8.8 |
-0.42 |
0 |
|
|
104675 |
50104867 |
1 |
FO4N5C34H40 |
AB4C5D34E40 |
-182.0 |
8.97 |
-8.54 |
-0.68 |
0 |
|
|
104676 |
50104868 |
1 |
FO4N5C34H40 |
AB4C5D34E40 |
-185.8 |
9.69 |
-8.51 |
-0.77 |
0 |
|
|
104677 |
50104869 |
1 |
N5O5C35H43 |
A5B5C35D43 |
-179.06 |
8.2 |
-8.36 |
-0.38 |
0 |
|
|
104678 |
50104870 |
1 |
N5O5C35H43 |
A5B5C35D43 |
-179.17 |
13.1 |
-8.3 |
-0.51 |
0 |
|
|
104679 |
50104873 |
1 |
O4N5C30H41 |
A4B5C30D41 |
-177.93 |
10.24 |
-8.6 |
-0.25 |
0 |
|
|
104680 |
50104874 |
1 |
FN5O5C34H40 |
AB5C5D34E40 |
-219.61 |
6.67 |
-8.82 |
-0.45 |
0 |
|
|
104681 |
50104877 |
1 |
FO4N5C34H40 |
AB4C5D34E40 |
-182.12 |
12.86 |
-8.87 |
-0.6 |
0 |
|
|
104682 |
50104878 |
1 |
FO4N5C34H40 |
AB4C5D34E40 |
-185.86 |
10.74 |
-8.81 |
-0.45 |
0 |
|
|
104683 |
50104879 |
1 |
FO5N6C42H53 |
AB5C6D42E53 |
-236.53 |
10.47 |
-8.78 |
-0.55 |
0 |
|
|
104684 |
50104882 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-227.91 |
7.65 |
-8.84 |
-0.58 |
0 |
|
|
104685 |
50104883 |
1 |
FO5N6C41H51 |
AB5C6D41E51 |
-235.52 |
7.98 |
-8.81 |
-0.44 |
0 |
|
|
104686 |
50104884 |
1 |
FO5N6C42H53 |
AB5C6D42E53 |
-241.25 |
11.64 |
-8.77 |
-0.3 |
0 |
|
|
104687 |
50104885 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-269.81 |
9.98 |
-8.71 |
-0.34 |
0 |
|
|
104688 |
50104886 |
1 |
FO5N6C41H51 |
AB5C6D41E51 |
-243.44 |
8.23 |
-8.75 |
-0.38 |
0 |
|
|
104689 |
50104887 |
1 |
FO5N6C42H53 |
AB5C6D42E53 |
-250.84 |
9.24 |
-8.88 |
-0.51 |
0 |
|
|
104690 |
50104888 |
1 |
FO5N6C43H55 |
AB5C6D43E55 |
-249.8 |
8.19 |
-8.78 |
-0.87 |
0 |
|
|
104691 |
50104889 |
1 |
FO5N6C40H51 |
AB5C6D40E51 |
-250.46 |
8.56 |
-8.71 |
-0.55 |
0 |
|
|
104692 |
50104890 |
1 |
ClO5N6C29H37 |
AB5C6D29E37 |
-135.75 |
14.34 |
-7.81 |
-1.45 |
0 |
|
|
104693 |
50104894 |
1 |
ClO5N6C30H37 |
AB5C6D30E37 |
-206.98 |
8.48 |
-8.96 |
-0.77 |
0 |
|
|
104694 |
50104896 |
2 |
N3O3C14H18 |
A3B3C14D18 |
-213.54 |
8.09 |
-9.25 |
-0.61 |
0 |
|
|
104695 |
50104897 |
1 |
BrO5N6C28H35 |
AB5C6D28E35 |
-199.59 |
5.13 |
-9.04 |
-0.72 |
0 |
|
|
104696 |
50104901 |
1 |
F2O5N6C34H38 |
A2B5C6D34E38 |
-254.12 |
10.37 |
-8.89 |
-0.74 |
0 |
|
|
104697 |
50104903 |
1 |
ClO5N6C28H35 |
AB5C6D28E35 |
-189.88 |
10.0 |
-8.92 |
-0.79 |
0 |
|
|
104698 |
50104904 |
1 |
ClO5N6C31H41 |
AB5C6D31E41 |
-208.62 |
5.4 |
-8.99 |
-0.67 |
0 |
|
|
104699 |
50104906 |
1 |
ClO5N6C31H41 |
AB5C6D31E41 |
-211.59 |
5.3 |
-8.8 |
-0.85 |
0 |
|
|
104700 |
50104908 |
1 |
ClO5N6C32H41 |
AB5C6D32E41 |
-198.98 |
12.71 |
-8.74 |
-0.58 |
0 |
|
|
104701 |
50104912 |
1 |
O5N6C31H42 |
A5B6C31D42 |
-196.4 |
12.51 |
-8.89 |
-0.61 |
0 |
|
|
104702 |
50104913 |
1 |
O5N6C32H44 |
A5B6C32D44 |
-217.36 |
10.72 |
-8.65 |
-0.64 |
0 |
|
|
104703 |
50104914 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-214.52 |
3.49 |
-9.0 |
-0.52 |
0 |
|
|
104704 |
50104915 |
1 |
O5N6C30H40 |
A5B6C30D40 |
-201.69 |
7.22 |
-8.72 |
-0.22 |
0 |
|
|
104705 |
50104921 |
1 |
N5O5C30H41 |
A5B5C30D41 |
-195.44 |
3.64 |
-8.3 |
-0.26 |
0 |
|
|
104706 |
50104922 |
1 |
BrO4N5C29H38 |
AB4C5D29E38 |
-150.6 |
9.22 |
-8.94 |
-0.51 |
0 |
|
|
104707 |
50104927 |
1 |
O4N5C30H41 |
A4B5C30D41 |
-179.69 |
5.12 |
-8.37 |
-0.29 |
0 |
|
|
104708 |
50104928 |
1 |
ClO4N5C34H40 |
AB4C5D34E40 |
-145.9 |
13.58 |
-8.64 |
-0.71 |
0 |
|
|
104709 |
50104929 |
1 |
FO4N5C35H42 |
AB4C5D35E42 |
-191.6 |
8.18 |
-8.71 |
-0.38 |
0 |
|
|
104710 |
50104930 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-189.3 |
6.91 |
-8.36 |
-0.22 |
0 |
|
|
104711 |
50104931 |
1 |
N5O5C34H41 |
A5B5C34D41 |
-174.53 |
5.43 |
-8.78 |
-0.39 |
0 |
|
|
104712 |
50104932 |
1 |
FO4N5C33H38 |
AB4C5D33E38 |
-179.3 |
10.24 |
-8.82 |
-0.85 |
0 |
|
|
104713 |
50104933 |
1 |
O4N5C29H39 |
A4B5C29D39 |
-180.4 |
11.16 |
-8.63 |
-0.19 |
0 |
|
|
104714 |
50104934 |
1 |
FO5N6C37H45 |
AB5C6D37E45 |
-224.49 |
8.04 |
-8.77 |
-0.43 |
0 |
|
|
104715 |
50104935 |
1 |
FO5N6C40H51 |
AB5C6D40E51 |
-244.99 |
4.36 |
-8.86 |
-0.6 |
0 |
|
|
104716 |
50104936 |
1 |
F2O5N6C43H48 |
A2B5C6D43E48 |
-246.17 |
16.91 |
-8.53 |
-0.66 |
0 |
|
|
104717 |
50104937 |
1 |
F3O5N6C42H45 |
A3B5C6D42E45 |
-289.18 |
16.07 |
-8.63 |
-0.96 |
0 |
|
|
104718 |
50104938 |
1 |
F3O5N6C42H45 |
A3B5C6D42E45 |
-285.83 |
4.58 |
-9.1 |
-0.55 |
0 |
|
|
104719 |
50104942 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-249.24 |
7.45 |
-8.87 |
-0.7 |
0 |
|
|
104720 |
50104943 |
2 |
N3O3C15H20 |
A3B3C15D20 |
-238.05 |
2.32 |
-8.99 |
-0.56 |
0 |
|
|
104721 |
50104944 |
2 |
N3O3C15H20 |
A3B3C15D20 |
-224.89 |
8.95 |
-8.88 |
-0.83 |
0 |
|
|
104722 |
50104946 |
1 |
BrO5N6C26H31 |
AB5C6D26E31 |
-183.0 |
4.76 |
-9.02 |
-0.76 |
0 |
|
|
104723 |
50104947 |
1 |
ClO5N6C29H37 |
AB5C6D29E37 |
-215.26 |
13.24 |
-8.81 |
-1.06 |
0 |
|
|
104724 |
50104948 |
1 |
ClO5N6C33H43 |
AB5C6D33E43 |
-206.91 |
9.31 |
-8.91 |
-0.46 |
0 |
|
|
104725 |
50104959 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-233.67 |
8.89 |
-8.71 |
-0.54 |
0 |
|
|
104726 |
50104960 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-210.02 |
7.17 |
-8.68 |
-0.47 |
0 |
|
|
104727 |
50104972 |
1 |
SO4N5C30H41 |
AB4C5D30E41 |
-158.35 |
8.84 |
-8.3 |
-0.12 |
0 |
|
|
104728 |
50104973 |
1 |
N5O5C31H43 |
A5B5C31D43 |
-201.15 |
8.13 |
-8.29 |
-0.41 |
0 |
|
|
104729 |
50105055 |
1 |
ClO5N6C31H41 |
AB5C6D31E41 |
-209.04 |
4.36 |
-8.84 |
-1.02 |
0 |
|
|
104730 |
50105176 |
1 |
BrO5N6C29H37 |
AB5C6D29E37 |
-187.0 |
6.42 |
-8.83 |
-0.71 |
0 |
|
|
104731 |
50105177 |
1 |
O5N6C30H40 |
A5B6C30D40 |
-200.64 |
8.46 |
-8.81 |
-0.23 |
0 |
|
|
104732 |
50105220 |
1 |
ClO5N6C32H41 |
AB5C6D32E41 |
-201.34 |
10.45 |
-8.79 |
-0.85 |
0 |
|
|
104733 |
50105221 |
1 |
ClO5N6C33H43 |
AB5C6D33E43 |
-208.88 |
9.49 |
-9.05 |
-0.39 |
0 |
|
|
104734 |
50105222 |
1 |
ClO5N6C34H45 |
AB5C6D34E45 |
-213.23 |
10.99 |
-8.7 |
-1.0 |
0 |
|
|
104735 |
50105223 |
1 |
ClN6O6C32H41 |
AB6C6D32E41 |
-235.76 |
12.21 |
-8.97 |
-1.12 |
0 |
|
|
104736 |
50105224 |
1 |
ClO5N6C33H43 |
AB5C6D33E43 |
-214.49 |
14.94 |
-8.65 |
-0.96 |
0 |
|
|
104737 |
50105225 |
1 |
FO5N6C35H41 |
AB5C6D35E41 |
-216.18 |
4.1 |
-8.8 |
-0.37 |
0 |
|
|
104738 |
50105227 |
1 |
F2O5N6C34H38 |
A2B5C6D34E38 |
-249.97 |
5.35 |
-8.84 |
-0.76 |
0 |
|
|
104739 |
50105228 |
1 |
F2O5N6C34H38 |
A2B5C6D34E38 |
-251.02 |
11.43 |
-8.87 |
-0.77 |
0 |
|
|
104740 |
50105229 |
1 |
FN6O6C35H41 |
AB6C6D35E41 |
-244.12 |
8.51 |
-8.75 |
-0.56 |
0 |
|
|
104741 |
50105230 |
1 |
FN6O6C35H41 |
AB6C6D35E41 |
-239.45 |
4.91 |
-8.72 |
-0.77 |
0 |
|
|
104742 |
50105231 |
1 |
FO5N6C31H41 |
AB5C6D31E41 |
-246.04 |
7.76 |
-8.83 |
-0.3 |
0 |
|
|
104743 |
50105233 |
1 |
FO5N6C32H43 |
AB5C6D32E43 |
-256.22 |
4.06 |
-8.9 |
-0.37 |
0 |
|
|
104744 |
50105235 |
1 |
FO5N6C34H45 |
AB5C6D34E45 |
-255.11 |
10.21 |
-8.79 |
-0.27 |
0 |
|
|
104745 |
50105240 |
1 |
F2O4N5C29H37 |
A2B4C5D29E37 |
-239.2 |
8.61 |
-9.1 |
-0.54 |
0 |
|
|
104746 |
50105241 |
1 |
ClO4N5C31H42 |
AB4C5D31E42 |
-183.9 |
9.61 |
-8.72 |
-1.1 |
0 |
|
|
104747 |
50105244 |
1 |
O4N5C33H45 |
A4B5C33D45 |
-181.66 |
1.89 |
-8.76 |
-0.22 |
0 |
|
|
104748 |
50105246 |
1 |
N5O5C35H43 |
A5B5C35D43 |
-182.86 |
2.95 |
-8.18 |
-0.44 |
0 |
|
|
104749 |
50105249 |
1 |
FO4N5C34H40 |
AB4C5D34E40 |
-188.87 |
6.75 |
-8.85 |
-0.45 |
0 |
|
|
104750 |
50105251 |
1 |
FO4N5C33H38 |
AB4C5D33E38 |
-174.98 |
6.98 |
-8.8 |
-0.48 |
0 |
|
|
104751 |
50105256 |
1 |
F2O4N5C34H39 |
A2B4C5D34E39 |
-233.1 |
7.37 |
-8.92 |
-0.52 |
0 |
|
|
104752 |
50105257 |
1 |
FO4N5C33H44 |
AB4C5D33E44 |
-228.2 |
5.49 |
-8.84 |
-0.32 |
0 |
|
|
104753 |
50105260 |
1 |
O5N6C30H40 |
A5B6C30D40 |
-202.35 |
7.72 |
-9.24 |
-0.71 |
0 |
|
|
104754 |
50105261 |
1 |
F2O5N6C32H34 |
A2B5C6D32E34 |
-252.19 |
8.11 |
-9.11 |
-0.6 |
0 |
|
|
104755 |
50105262 |
1 |
O5N6C32H36 |
A5B6C32D36 |
-162.04 |
4.78 |
-8.82 |
-0.52 |
0 |
|
|
104756 |
50105263 |
1 |
FO5N6C32H35 |
AB5C6D32E35 |
-208.3 |
8.91 |
-8.92 |
-0.78 |
0 |