List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
93231 |
49992606 |
1 |
ClO3N4C30H39 |
AB3C4D30E39 |
-136.65 |
7.86 |
-8.89 |
-0.4 |
0 |
|
|
93232 |
49992608 |
1 |
O3N4C31H42 |
A3B4C31D42 |
-135.77 |
5.2 |
-8.6 |
-0.1 |
0 |
|
|
93233 |
49992616 |
1 |
N4O5C31H42 |
A4B5C31D42 |
-197.3 |
6.51 |
-8.66 |
-0.25 |
0 |
|
|
93234 |
49992622 |
1 |
ClO3N4C30H39 |
AB3C4D30E39 |
-142.1 |
8.68 |
-8.89 |
-0.32 |
0 |
|
|
93235 |
49992638 |
1 |
ClO3N4C29H37 |
AB3C4D29E37 |
-132.28 |
6.37 |
-8.91 |
-0.34 |
0 |
|
|
93236 |
49992644 |
1 |
ClO5N6C37H49 |
AB5C6D37E49 |
-217.18 |
4.85 |
-9.04 |
-0.87 |
0 |
|
|
93237 |
49992645 |
1 |
ClO5N6C38H51 |
AB5C6D38E51 |
-237.98 |
5.36 |
-8.74 |
-0.89 |
0 |
|
|
93238 |
49992663 |
1 |
F2O4N5C32H41 |
A2B4C5D32E41 |
-259.44 |
6.47 |
-8.91 |
-0.6 |
0 |
|
|
93239 |
49992664 |
1 |
F2O4N5C32H41 |
A2B4C5D32E41 |
-257.88 |
0.42 |
-9.18 |
-0.5 |
0 |
|
|
93240 |
49992665 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-239.74 |
6.82 |
-8.81 |
-0.52 |
0 |
|
|
93241 |
49992682 |
1 |
ClO5N6C36H47 |
AB5C6D36E47 |
-221.76 |
5.17 |
-9.0 |
-0.92 |
0 |
|
|
93242 |
49992702 |
1 |
ClO5N6C36H49 |
AB5C6D36E49 |
-235.58 |
6.79 |
-8.86 |
-0.85 |
0 |
|
|
93243 |
49992712 |
1 |
FO5N6C41H49 |
AB5C6D41E49 |
-225.85 |
5.62 |
-8.28 |
-0.66 |
0 |
|
|
93244 |
49992722 |
1 |
ClO5N6C41H49 |
AB5C6D41E49 |
-183.82 |
1.8 |
-8.2 |
-0.57 |
0 |
|
|
93245 |
49992723 |
1 |
O3N4C29H38 |
A3B4C29D38 |
-122.59 |
7.49 |
-8.86 |
-0.2 |
0 |
|
|
93246 |
49992724 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-210.58 |
8.64 |
-8.85 |
-0.22 |
0 |
|
|
93247 |
49992725 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-230.88 |
4.61 |
-9.04 |
-0.35 |
0 |
|
|
93248 |
49992726 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-227.65 |
5.93 |
-8.88 |
-0.26 |
0 |
|
|
93249 |
49992727 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-219.15 |
8.99 |
-9.01 |
-0.41 |
0 |
|
|
93250 |
49992736 |
1 |
ClO5N6C39H47 |
AB5C6D39E47 |
-194.49 |
8.54 |
-8.88 |
-1.03 |
0 |
|
|
93251 |
49992739 |
1 |
O5N6C35H48 |
A5B6C35D48 |
-214.22 |
1.19 |
-8.99 |
-0.4 |
0 |
|
|
93252 |
49992740 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-242.23 |
1.54 |
-8.7 |
-0.39 |
0 |
|
|
93253 |
49992741 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-227.51 |
8.58 |
-8.89 |
-0.39 |
0 |
|
|
93254 |
49992742 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-229.9 |
6.84 |
-9.08 |
-0.67 |
0 |
|
|
93255 |
49992745 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-224.84 |
5.28 |
-8.85 |
-0.59 |
0 |
|
|
93256 |
49992759 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-239.76 |
5.48 |
-8.64 |
-0.36 |
0 |
|
|
93257 |
49992762 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-228.68 |
8.14 |
-8.71 |
-0.51 |
0 |
|
|
93258 |
49992765 |
1 |
F2O5N6C39H46 |
A2B5C6D39E46 |
-274.34 |
8.6 |
-8.74 |
-1.03 |
0 |
|
|
93259 |
49992771 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-234.78 |
7.33 |
-8.88 |
-0.87 |
0 |
|
|
93260 |
49992772 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-239.41 |
7.02 |
-8.72 |
-0.6 |
0 |
|
|
93261 |
49992773 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-238.87 |
5.19 |
-9.0 |
-0.49 |
0 |
|
|
93262 |
49992774 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-233.4 |
9.45 |
-8.8 |
-0.57 |
0 |
|
|
93263 |
49992775 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-213.55 |
10.88 |
-8.87 |
-0.79 |
0 |
|
|
93264 |
49992787 |
1 |
ClO5N6C42H51 |
AB5C6D42E51 |
-199.4 |
3.75 |
-8.51 |
-0.63 |
0 |
|
|
93265 |
49992800 |
1 |
O5N6C33H44 |
A5B6C33D44 |
-210.47 |
4.19 |
-8.98 |
-0.58 |
0 |
|
|
93266 |
49992828 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-233.73 |
8.3 |
-8.85 |
-0.51 |
0 |
|
|
93267 |
49992831 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-235.53 |
9.75 |
-8.75 |
-0.52 |
0 |
|
|
93268 |
49992847 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-258.47 |
11.05 |
-9.18 |
-0.78 |
0 |
|
|
93269 |
49992848 |
1 |
ClO5N6C38H51 |
AB5C6D38E51 |
-233.12 |
10.54 |
-8.99 |
-0.69 |
0 |
|
|
93270 |
49992853 |
2 |
N3O3C21H26 |
A3B3C21D26 |
-222.44 |
2.02 |
-8.52 |
-0.62 |
0 |
|
|
93271 |
49992855 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-237.8 |
5.88 |
-8.69 |
-0.1 |
0 |
|
|
93272 |
49992870 |
1 |
FO5N6C39H47 |
AB5C6D39E47 |
-231.53 |
12.01 |
-8.93 |
-0.82 |
0 |
|
|
93273 |
49992877 |
1 |
ClO5N6C40H49 |
AB5C6D40E49 |
-211.26 |
16.52 |
-8.36 |
-0.7 |
0 |
|
|
93274 |
49992881 |
2 |
N3O3C20H28 |
A3B3C20D28 |
-265.84 |
5.28 |
-8.86 |
-0.3 |
0 |
|
|
93275 |
49992882 |
1 |
N6O6C37H52 |
A6B6C37D52 |
-265.91 |
8.61 |
-8.81 |
-0.28 |
0 |
|
|
93276 |
49992895 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-260.15 |
6.49 |
-8.13 |
-0.36 |
0 |
|
|
93277 |
49992898 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-234.28 |
9.86 |
-8.9 |
-0.39 |
0 |
|
|
93278 |
49992909 |
1 |
FO5N6C39H47 |
AB5C6D39E47 |
-235.33 |
9.48 |
-8.86 |
-0.54 |
0 |
|
|
93279 |
49992911 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-225.19 |
7.88 |
-9.08 |
-0.36 |
0 |
|
|
93280 |
49992912 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-221.71 |
6.87 |
-9.05 |
-0.2 |
0 |
|
|
93281 |
49992913 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-240.23 |
8.2 |
-9.02 |
-0.26 |
0 |
|
|
93283 |
49992919 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-240.92 |
8.6 |
-8.98 |
-0.32 |
0 |
|
|
93285 |
49992940 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-266.0 |
8.31 |
-8.19 |
-0.18 |
0 |
|
|
93286 |
49992942 |
1 |
FO5N6C37H51 |
AB5C6D37E51 |
-281.89 |
4.48 |
-8.76 |
-0.27 |
0 |
|
|
93287 |
49992944 |
1 |
FO5N6C39H53 |
AB5C6D39E53 |
-278.23 |
6.66 |
-9.03 |
-0.49 |
0 |
|
|
93288 |
49992950 |
1 |
ClO5N6C35H47 |
AB5C6D35E47 |
-235.99 |
6.42 |
-8.64 |
-0.52 |
0 |
|
|
93289 |
49992972 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-219.84 |
7.89 |
-9.04 |
-0.56 |
0 |
|
|
93290 |
49992976 |
2 |
N3O3C21H29 |
A3B3C21D29 |
-274.83 |
7.43 |
-8.32 |
-0.16 |
0 |
|
|
93291 |
49992978 |
1 |
FO5N6C42H51 |
AB5C6D42E51 |
-236.83 |
13.76 |
-8.66 |
-0.82 |
0 |
|
|
93292 |
49992986 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-241.84 |
9.49 |
-8.81 |
-0.44 |
0 |
|
|
93294 |
49992995 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-245.64 |
6.26 |
-8.79 |
-0.25 |
0 |
|
|
93295 |
49992998 |
1 |
F2O5N6C40H48 |
A2B5C6D40E48 |
-289.18 |
5.01 |
-8.89 |
-0.72 |
0 |
|
|
93296 |
49993010 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-238.62 |
6.31 |
-8.88 |
-0.45 |
0 |
|
|
93297 |
49993032 |
1 |
ClO5N6C39H47 |
AB5C6D39E47 |
-188.84 |
1.14 |
-8.48 |
-0.45 |
0 |
|
|
93298 |
49993033 |
1 |
ClO5N6C36H49 |
AB5C6D36E49 |
-233.61 |
4.44 |
-8.39 |
-0.3 |
0 |
|
|
93300 |
49993083 |
1 |
O5N6C38H54 |
A5B6C38D54 |
-234.65 |
8.32 |
-8.88 |
-0.45 |
0 |
|
|
93301 |
49993084 |
1 |
FO5N6C41H51 |
AB5C6D41E51 |
-240.46 |
8.06 |
-9.01 |
-0.44 |
0 |
|
|
93302 |
49993102 |
1 |
O5N6C42H58 |
A5B6C42D58 |
-232.34 |
8.41 |
-8.92 |
-0.52 |
0 |
|
|
93304 |
49993105 |
1 |
F2O5N6C42H50 |
A2B5C6D42E50 |
-284.08 |
9.03 |
-8.78 |
-0.39 |
0 |
|
|
93305 |
49993106 |
1 |
FO5N6C41H55 |
AB5C6D41E55 |
-282.13 |
10.7 |
-8.7 |
-0.24 |
0 |
|
|
93306 |
49993107 |
1 |
FN6O6C42H51 |
AB6C6D42E51 |
-270.44 |
1.69 |
-8.62 |
-0.58 |
0 |
|
|
93307 |
49993123 |
1 |
ClF3O4N5C33H41 |
AB3C4D5E33F41 |
-343.28 |
7.97 |
-8.88 |
-1.08 |
0 |
|
|
93308 |
49993124 |
1 |
N5O5C33H45 |
A5B5C33D45 |
-207.6 |
8.91 |
-8.49 |
-0.08 |
0 |
|
|
93309 |
49993127 |
1 |
O5N6C41H52 |
A5B6C41D52 |
-201.91 |
11.33 |
-8.77 |
-0.74 |
0 |
|
|
93310 |
49993132 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-220.43 |
8.21 |
-8.91 |
-0.22 |
0 |
|
|
93311 |
49993133 |
1 |
O5N6C36H50 |
A5B6C36D50 |
-213.37 |
1.79 |
-9.11 |
-0.44 |
0 |
|
|
93312 |
49993134 |
1 |
O5N6C37H52 |
A5B6C37D52 |
-239.61 |
10.54 |
-8.71 |
-0.24 |
0 |
|
|
93313 |
49993139 |
1 |
O5N6C40H54 |
A5B6C40D54 |
-220.35 |
3.91 |
-8.96 |
-0.42 |
0 |
|
|
93314 |
49993151 |
1 |
FO5N6C38H51 |
AB5C6D38E51 |
-276.42 |
5.25 |
-8.71 |
-0.2 |
0 |
|
|
93315 |
49993152 |
1 |
FO5N6C37H49 |
AB5C6D37E49 |
-270.1 |
4.0 |
-8.63 |
-0.39 |
0 |
|
|
93316 |
49993156 |
1 |
FO5N6C41H55 |
AB5C6D41E55 |
-274.49 |
5.38 |
-8.59 |
-0.17 |
0 |
|
|
93317 |
49993158 |
1 |
ClO5N6C42H51 |
AB5C6D42E51 |
-198.15 |
9.84 |
-8.78 |
-0.47 |
0 |
|
|
93318 |
49993159 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-187.04 |
6.29 |
-8.54 |
-0.33 |
0 |
|
|
93319 |
49993162 |
1 |
N5O5C33H45 |
A5B5C33D45 |
-211.79 |
7.47 |
-8.71 |
-0.1 |
0 |
|
|
93320 |
49993163 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-186.56 |
8.45 |
-8.78 |
-0.13 |
0 |
|
|
93321 |
49993166 |
1 |
Cl2O4N5C32H41 |
A2B4C5D32E41 |
-191.04 |
6.3 |
-8.84 |
-0.8 |
0 |
|
|
93322 |
49993170 |
1 |
BrClO4N5C32H41 |
ABC4D5E32F41 |
-179.44 |
5.62 |
-8.94 |
-0.41 |
0 |
|
|
93323 |
49993175 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-259.61 |
8.54 |
-9.04 |
-0.5 |
0 |
|
|
93324 |
49993181 |
1 |
O5N6C38H54 |
A5B6C38D54 |
-234.09 |
10.43 |
-9.18 |
-0.36 |
0 |
|
|
93325 |
49993184 |
1 |
F2O5N6C42H50 |
A2B5C6D42E50 |
-281.4 |
11.79 |
-8.72 |
-1.2 |
0 |
|
|
93326 |
49993197 |
1 |
ClO5N6C36H47 |
AB5C6D36E47 |
-226.63 |
8.84 |
-8.82 |
-0.36 |
0 |
|
|
93327 |
49993198 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-241.52 |
3.15 |
-8.55 |
-0.19 |
0 |
|
|
93328 |
49993421 |
1 |
F2O4N5C38H45 |
A2B4C5D38E45 |
-241.83 |
6.61 |
-8.74 |
-0.99 |
0 |
|
|
93329 |
49993490 |
1 |
O4N5C37H51 |
A4B5C37D51 |
-192.13 |
9.76 |
-8.73 |
-0.43 |
0 |
|
|
93330 |
49993496 |
1 |
O4N5C38H47 |
A4B5C38D47 |
-143.06 |
8.82 |
-8.8 |
-0.75 |
0 |
|
|
93332 |
49993544 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-221.82 |
6.41 |
-9.06 |
-0.35 |
0 |
|
|
93333 |
49993553 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-237.22 |
3.73 |
-9.23 |
-0.57 |
0 |
|
|
93334 |
49993565 |
1 |
FO4N5C36H42 |
AB4C5D36E42 |
-180.07 |
2.69 |
-8.79 |
-0.65 |
0 |
|
|
93335 |
49993572 |
1 |
BrO4N5C33H44 |
AB4C5D33E44 |
-180.51 |
9.34 |
-8.91 |
-0.45 |
0 |
|
|
93336 |
49993627 |
1 |
F2O4N5C36H41 |
A2B4C5D36E41 |
-228.22 |
3.91 |
-8.8 |
-0.76 |
0 |