List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
91013 |
49972818 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-225.94 |
4.55 |
-8.36 |
-0.14 |
0 |
|
|
91014 |
49972819 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-218.19 |
9.88 |
-8.54 |
-0.25 |
0 |
|
|
91015 |
49972820 |
1 |
ClO5N6C39H47 |
AB5C6D39E47 |
-182.74 |
9.72 |
-8.37 |
-0.66 |
0 |
|
|
91016 |
49972821 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-235.25 |
4.92 |
-8.24 |
-0.26 |
0 |
|
|
91017 |
49972822 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-239.39 |
7.46 |
-8.45 |
-0.44 |
0 |
|
|
91018 |
49972843 |
1 |
F2O5N6C40H48 |
A2B5C6D40E48 |
-283.56 |
5.84 |
-9.07 |
-0.57 |
0 |
|
|
91019 |
49972846 |
1 |
ClO5N6C33H43 |
AB5C6D33E43 |
-219.69 |
10.66 |
-8.93 |
-0.72 |
0 |
|
|
91020 |
49972848 |
1 |
ClO5N6C36H49 |
AB5C6D36E49 |
-227.18 |
6.29 |
-8.85 |
-0.75 |
0 |
|
|
91021 |
49972851 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-233.28 |
8.38 |
-8.88 |
-0.84 |
0 |
|
|
91022 |
49972852 |
1 |
ClO5N6C37H49 |
AB5C6D37E49 |
-221.57 |
5.15 |
-8.91 |
-0.43 |
0 |
|
|
91023 |
49972857 |
1 |
O5N6C41H52 |
A5B6C41D52 |
-199.01 |
3.4 |
-8.24 |
-0.25 |
0 |
|
|
91024 |
49972858 |
1 |
O5N6C41H52 |
A5B6C41D52 |
-196.03 |
8.1 |
-8.55 |
-0.52 |
0 |
|
|
91025 |
49972863 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-235.05 |
5.98 |
-8.35 |
-0.63 |
0 |
|
|
91026 |
49972877 |
1 |
FO4N5C33H44 |
AB4C5D33E44 |
-220.78 |
5.98 |
-8.88 |
-0.45 |
0 |
|
|
91027 |
49972880 |
1 |
SO4N7C29H41 |
AB4C7D29E41 |
-150.55 |
5.66 |
-9.06 |
-0.46 |
0 |
|
|
91028 |
49972881 |
1 |
N5O6C34H47 |
A5B6C34D47 |
-247.73 |
5.22 |
-8.22 |
-0.14 |
0 |
|
|
91029 |
49972882 |
1 |
SO4N7C31H45 |
AB4C7D31E45 |
-157.91 |
10.66 |
-9.22 |
-0.46 |
0 |
|
|
91030 |
49972893 |
1 |
ClO5N6C33H43 |
AB5C6D33E43 |
-211.49 |
3.95 |
-8.94 |
-0.88 |
0 |
|
|
91031 |
49972898 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-234.1 |
4.47 |
-8.2 |
-0.14 |
0 |
|
|
91032 |
49972899 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-226.65 |
9.97 |
-8.86 |
-0.42 |
0 |
|
|
91033 |
49972905 |
2 |
N3O3C20H25 |
A3B3C20D25 |
-225.81 |
5.36 |
-8.51 |
-0.27 |
0 |
|
|
91034 |
49972906 |
1 |
FO5N6C39H47 |
AB5C6D39E47 |
-228.7 |
10.85 |
-8.74 |
-0.66 |
0 |
|
|
91035 |
49972909 |
1 |
ClF3O4N5C33H41 |
AB3C4D5E33F41 |
-331.73 |
6.45 |
-8.85 |
-0.9 |
0 |
|
|
91036 |
49972924 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-185.01 |
11.0 |
-8.79 |
-0.07 |
0 |
|
|
91037 |
49972926 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-174.63 |
8.32 |
-8.91 |
-0.14 |
0 |
|
|
91038 |
49972930 |
1 |
F3O4N5C32H40 |
A3B4C5D32E40 |
-296.6 |
7.04 |
-9.01 |
-0.93 |
0 |
|
|
91039 |
49972939 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-256.91 |
2.93 |
-8.91 |
-0.4 |
0 |
|
|
91041 |
49972941 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-236.27 |
9.77 |
-8.95 |
-0.41 |
0 |
|
|
91042 |
49972942 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-233.12 |
8.33 |
-9.11 |
-0.56 |
0 |
|
|
91043 |
49972949 |
1 |
FO5N6C39H47 |
AB5C6D39E47 |
-228.94 |
4.95 |
-8.84 |
-0.72 |
0 |
|
|
91044 |
49972952 |
2 |
N3O3C20H25 |
A3B3C20D25 |
-223.71 |
12.61 |
-8.43 |
-0.5 |
0 |
|
|
91045 |
49972956 |
1 |
ClO5N6C39H47 |
AB5C6D39E47 |
-195.31 |
6.43 |
-8.79 |
-0.76 |
0 |
|
|
91046 |
49972960 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-220.24 |
1.49 |
-8.85 |
-0.15 |
0 |
|
|
91047 |
49972962 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-242.68 |
4.43 |
-8.97 |
-0.46 |
0 |
|
|
91048 |
49972963 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-222.22 |
4.33 |
-8.92 |
-0.26 |
0 |
|
|
91049 |
49972969 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-229.62 |
3.73 |
-9.06 |
-0.7 |
0 |
|
|
91050 |
49972974 |
1 |
FO4N5C33H44 |
AB4C5D33E44 |
-215.54 |
13.21 |
-8.68 |
-0.39 |
0 |
|
|
91051 |
49972976 |
1 |
FO4N5C33H44 |
AB4C5D33E44 |
-223.9 |
6.58 |
-8.79 |
-0.37 |
0 |
|
|
91052 |
49972990 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-215.46 |
8.87 |
-8.86 |
-0.58 |
0 |
|
|
91053 |
49973006 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-267.36 |
7.97 |
-8.99 |
-1.0 |
0 |
|
|
91054 |
49973012 |
1 |
FO5N6C39H47 |
AB5C6D39E47 |
-229.29 |
7.65 |
-8.85 |
-0.74 |
0 |
|
|
91055 |
49973038 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-240.29 |
10.38 |
-8.89 |
-0.95 |
0 |
|
|
91056 |
49973045 |
1 |
FN6O6C40H49 |
AB6C6D40E49 |
-259.19 |
13.12 |
-8.54 |
-0.72 |
0 |
|
|
91057 |
49973046 |
1 |
N6O6C41H52 |
A6B6C41D52 |
-224.29 |
13.88 |
-8.49 |
-0.34 |
0 |
|
|
91058 |
49973048 |
1 |
N6O6C41H52 |
A6B6C41D52 |
-230.52 |
7.92 |
-8.2 |
-0.28 |
0 |
|
|
91059 |
49973055 |
1 |
O5N6C33H44 |
A5B6C33D44 |
-207.15 |
4.89 |
-9.24 |
-0.48 |
0 |
|
|
91060 |
49973056 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-204.01 |
3.17 |
-9.07 |
-0.48 |
0 |
|
|
91062 |
49973060 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-224.61 |
8.55 |
-9.09 |
-0.52 |
0 |
|
|
91063 |
49973064 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-245.23 |
7.56 |
-8.9 |
-0.77 |
0 |
|
|
91064 |
49973073 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-236.82 |
6.14 |
-8.8 |
-0.49 |
0 |
|
|
91065 |
49973074 |
1 |
O5N6C40H50 |
A5B6C40D50 |
-185.01 |
7.53 |
-8.8 |
-0.48 |
0 |
|
|
91066 |
49973091 |
2 |
N3O3C19H27 |
A3B3C19D27 |
-273.27 |
10.95 |
-8.65 |
-0.35 |
0 |
|
|
91067 |
49973104 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-225.83 |
5.81 |
-8.58 |
-0.4 |
0 |
|
|
91069 |
49973112 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-273.49 |
10.21 |
-8.8 |
-0.96 |
0 |
|
|
91070 |
49973115 |
1 |
O5N6C33H44 |
A5B6C33D44 |
-209.73 |
8.63 |
-9.03 |
-0.38 |
0 |
|
|
91071 |
49973121 |
1 |
O5N6C37H50 |
A5B6C37D50 |
-213.36 |
11.08 |
-8.83 |
-0.39 |
0 |
|
|
91072 |
49973122 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-213.72 |
7.14 |
-8.75 |
-0.68 |
0 |
|
|
91073 |
49973137 |
1 |
ClO5N6C40H49 |
AB5C6D40E49 |
-193.0 |
8.79 |
-8.84 |
-1.09 |
0 |
|
|
91074 |
49973160 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-228.49 |
12.57 |
-8.98 |
-0.33 |
0 |
|
|
91075 |
49973161 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-229.07 |
11.48 |
-8.97 |
-0.22 |
0 |
|
|
91076 |
49973167 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-232.28 |
8.81 |
-8.91 |
-0.58 |
0 |
|
|
91077 |
49973168 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-271.4 |
6.21 |
-9.08 |
-0.67 |
0 |
|
|
91078 |
49973169 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-269.32 |
9.42 |
-8.74 |
-0.69 |
0 |
|
|
91079 |
49973170 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-237.38 |
8.23 |
-8.81 |
-0.81 |
0 |
|
|
91081 |
49973172 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-275.82 |
9.99 |
-8.93 |
-0.5 |
0 |
|
|
91082 |
49973173 |
1 |
O5N6C39H48 |
A5B6C39D48 |
-179.23 |
6.4 |
-8.85 |
-0.73 |
0 |
|
|
91083 |
49973174 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-245.81 |
4.12 |
-9.01 |
-0.57 |
0 |
|
|
91084 |
49973187 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-229.71 |
6.29 |
-8.68 |
-0.42 |
0 |
|
|
91087 |
49973198 |
1 |
SO4N6C26H36 |
AB4C6D26E36 |
-125.95 |
9.14 |
-8.89 |
-1.36 |
0 |
|
|
91088 |
49973218 |
1 |
SO4N6C25H34 |
AB4C6D25E34 |
-127.14 |
10.22 |
-8.75 |
-0.37 |
0 |
|
|
91089 |
49973227 |
1 |
ClN4O5C28H35 |
AB4C5D28E35 |
-186.55 |
6.0 |
-8.76 |
-0.37 |
0 |
|
|
91090 |
49973229 |
1 |
BrN4O4C29H37 |
AB4C4D29E37 |
-154.65 |
7.79 |
-8.68 |
-0.01 |
0 |
|
|
91091 |
49973235 |
1 |
ClN4O4C27H33 |
AB4C4D27E33 |
-144.87 |
8.71 |
-8.99 |
-0.68 |
0 |
|
|
91092 |
49973244 |
4 |
NOC7H9 |
ABC7D9 |
-144.43 |
5.29 |
-8.7 |
-0.28 |
0 |
|
|
91093 |
49973258 |
1 |
F3N4O4C28H33 |
A3B4C4D28E33 |
-302.9 |
8.89 |
-9.07 |
-0.82 |
0 |
|
|
91094 |
49973260 |
1 |
N6O6C39H46 |
A6B6C39D46 |
-206.45 |
9.42 |
-8.82 |
-0.4 |
0 |
|
|
91095 |
49973268 |
1 |
ClN6O6C38H43 |
AB6C6D38E43 |
-208.07 |
11.33 |
-8.65 |
-0.71 |
0 |
|
|
91096 |
49973276 |
1 |
N5O6C33H41 |
A5B6C33D41 |
-215.98 |
5.8 |
-9.12 |
-0.64 |
0 |
|
|
91097 |
49973279 |
1 |
F2N5O5C31H37 |
A2B5C5D31E37 |
-271.14 |
10.98 |
-8.76 |
-0.73 |
0 |
|
|
91098 |
49973280 |
1 |
F2N5O5C31H37 |
A2B5C5D31E37 |
-268.05 |
3.59 |
-9.2 |
-0.45 |
0 |
|
|
91099 |
49973282 |
1 |
FN5O5C32H40 |
AB5C5D32E40 |
-237.11 |
9.23 |
-9.01 |
-0.34 |
0 |
|
|
91100 |
49973287 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-243.76 |
12.37 |
-8.97 |
-0.6 |
0 |
|
|
91101 |
49973290 |
1 |
ClN6O6C38H49 |
AB6C6D38E49 |
-250.86 |
5.47 |
-9.15 |
-0.5 |
0 |
|
|
91102 |
49973300 |
1 |
FN6O6C39H45 |
AB6C6D39E45 |
-255.74 |
8.26 |
-8.74 |
-0.34 |
0 |
|
|
91103 |
49973304 |
1 |
N6O7C40H48 |
A6B7C40D48 |
-249.04 |
11.63 |
-8.85 |
-0.4 |
0 |
|
|
91104 |
49973306 |
1 |
N6O7C39H46 |
A6B7C39D46 |
-232.99 |
6.14 |
-8.13 |
-0.31 |
0 |
|
|
91105 |
49973338 |
1 |
N6O7C39H52 |
A6B7C39D52 |
-288.02 |
12.75 |
-7.72 |
-0.48 |
0 |
|
|
91106 |
49973341 |
1 |
N6O7C40H48 |
A6B7C40D48 |
-246.13 |
13.13 |
-8.62 |
-0.47 |
0 |
|
|
91107 |
49973342 |
1 |
N6O7C40H48 |
A6B7C40D48 |
-242.91 |
8.63 |
-8.36 |
-0.38 |
0 |
|
|
91108 |
49973347 |
1 |
N5O5C29H37 |
A5B5C29D37 |
-188.32 |
12.07 |
-8.5 |
-0.24 |
0 |
|
|
91109 |
49973353 |
2 |
N3O3C19H25 |
A3B3C19D25 |
-242.01 |
3.19 |
-9.16 |
-0.44 |
0 |
|
|
91110 |
49973371 |
2 |
N3O3C19H22 |
A3B3C19D22 |
-198.89 |
9.02 |
-8.97 |
-0.87 |
0 |
|
|
91111 |
49973377 |
1 |
FN6O6C39H45 |
AB6C6D39E45 |
-251.73 |
10.64 |
-8.55 |
-0.78 |
0 |
|
|
91112 |
49973391 |
1 |
FN6O6C39H45 |
AB6C6D39E45 |
-254.06 |
3.14 |
-8.76 |
-0.43 |
0 |
|
|
91113 |
49973394 |
2 |
FN3O3C19H21 |
AB3C3D19E21 |
-290.31 |
9.2 |
-9.08 |
-0.82 |
0 |
|
|
91114 |
49973399 |
1 |
FN6O6C38H43 |
AB6C6D38E43 |
-249.33 |
6.4 |
-8.97 |
-0.64 |
0 |
|
|
91115 |
49973403 |
1 |
ClN6O6C32H39 |
AB6C6D32E39 |
-232.39 |
8.96 |
-8.96 |
-0.86 |
0 |
|
|
91116 |
49973404 |
1 |
ClN6O6C34H43 |
AB6C6D34E43 |
-234.44 |
5.62 |
-9.08 |
-0.58 |
0 |
|
|
91117 |
49973410 |
1 |
N6O7C40H48 |
A6B7C40D48 |
-243.45 |
16.5 |
-8.44 |
-0.72 |
0 |
|
|
91118 |
49973417 |
1 |
FN6O6C40H47 |
AB6C6D40E47 |
-263.25 |
8.02 |
-8.54 |
-0.47 |
0 |