List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
302290 |
124361103 |
1 |
N5O6C23H25 |
A5B6C23D25 |
-220.61 |
6.27 |
-9.04 |
-0.51 |
0 |
|
|
302291 |
124361104 |
1 |
N4O5C24H28 |
A4B5C24D28 |
-181.86 |
4.64 |
-9.04 |
-0.51 |
0 |
|
|
302292 |
124361105 |
1 |
N4O5C24H28 |
A4B5C24D28 |
-185.03 |
5.9 |
-9.2 |
-0.64 |
0 |
|
|
302293 |
124361107 |
1 |
N4O6H26C27 |
A4B6C26D27 |
-185.8 |
3.71 |
-8.96 |
-0.4 |
0 |
|
|
302294 |
124361108 |
1 |
N4O6H26C27 |
A4B6C26D27 |
-184.78 |
7.62 |
-9.09 |
-0.5 |
0 |
|
|
302295 |
124361117 |
1 |
N4O5C18H24 |
A4B5C18D24 |
-206.2 |
2.07 |
-8.76 |
-0.37 |
0 |
|
|
302296 |
124361119 |
1 |
N3O4C23H25 |
A3B4C23D25 |
-112.46 |
2.48 |
-8.58 |
-0.19 |
0 |
|
|
302297 |
124361132 |
1 |
SN3O5C21H27 |
AB3C5D21E27 |
-210.45 |
6.85 |
-8.94 |
-0.24 |
0 |
|
|
302298 |
124361140 |
1 |
N5O6C18H23 |
A5B6C18D23 |
-249.06 |
7.62 |
-9.25 |
-0.68 |
0 |
|
|
302299 |
124361153 |
1 |
NO10C24H25 |
AB10C24D25 |
-325.73 |
6.54 |
-8.53 |
-1.22 |
0 |
|
|
302300 |
124361154 |
1 |
NO10C24H25 |
AB10C24D25 |
-327.78 |
5.32 |
-8.28 |
-1.4 |
0 |
|
|
302301 |
124361156 |
1 |
NO10C25H25 |
AB10C25D25 |
-323.75 |
7.33 |
-8.65 |
-1.46 |
0 |
|
|
302302 |
124361163 |
1 |
NSO7C23H25 |
ABC7D23E25 |
-264.94 |
1.99 |
-8.77 |
-0.92 |
0 |
|
|
302304 |
124361171 |
1 |
BrClN3O3H21C22 |
ABC3D3E21F22 |
-76.08 |
6.18 |
-8.73 |
-0.37 |
0 |
|
|
302305 |
124361182 |
1 |
BrClN4O4C22H22 |
ABC4D4E22F22 |
-129.11 |
6.69 |
-8.75 |
-0.65 |
0 |
|
|
302306 |
124361183 |
1 |
BrClN3O4C21H21 |
ABC3D4E21F21 |
-127.97 |
7.27 |
-8.69 |
-0.33 |
0 |
|
|
302308 |
124361187 |
1 |
N3O4C25H27 |
A3B4C25D27 |
-136.23 |
3.09 |
-9.0 |
-0.61 |
0 |
|
|
302309 |
124361190 |
1 |
ClN4O4C23H25 |
AB4C4D23E25 |
-135.87 |
3.74 |
-8.81 |
-0.5 |
0 |
|
|
302310 |
124361191 |
1 |
ClN4O4C23H25 |
AB4C4D23E25 |
-143.23 |
6.67 |
-8.55 |
-0.33 |
0 |
|
|
302311 |
124361194 |
1 |
N3O4C24H29 |
A3B4C24D29 |
-123.85 |
4.45 |
-8.78 |
-0.6 |
0 |
|
|
302312 |
124361197 |
1 |
BrN3O4C25H28 |
AB3C4D25E28 |
-143.28 |
6.15 |
-9.21 |
-0.84 |
0 |
|
|
302313 |
124361198 |
1 |
N5O6C20H27 |
A5B6C20D27 |
-256.42 |
3.45 |
-9.19 |
-0.61 |
0 |
|
|
302314 |
124361200 |
1 |
N5O6C20H27 |
A5B6C20D27 |
-262.9 |
5.04 |
-8.85 |
-0.46 |
0 |
|
|
302315 |
124361207 |
1 |
ClN3O3C28H28 |
AB3C3D28E28 |
-72.06 |
2.58 |
-8.65 |
-0.41 |
0 |
|
|
302316 |
124361209 |
1 |
BrSN3O3C22H24 |
ABC3D3E22F24 |
-71.92 |
4.79 |
-8.45 |
-0.78 |
0 |
|
|
302317 |
124361225 |
1 |
BrClN3O3C23H25 |
ABC3D3E23F25 |
-90.49 |
2.58 |
-9.1 |
-0.81 |
0 |
|
|
302318 |
124361226 |
1 |
NO11H23C24 |
AB11C23D24 |
-363.52 |
2.28 |
-8.66 |
-1.5 |
0 |
|
|
302319 |
124361228 |
1 |
N3O4C26H31 |
A3B4C26D31 |
-153.24 |
4.17 |
-9.16 |
-0.64 |
0 |
|
|
302320 |
124361230 |
1 |
ClN3O4C23H26 |
AB3C4D23E26 |
-142.58 |
4.49 |
-8.67 |
-0.57 |
0 |
|
|
302321 |
124361233 |
1 |
N3O5C29H29 |
A3B5C29D29 |
-157.56 |
3.75 |
-8.9 |
-0.68 |
0 |
|
|
302322 |
124361235 |
1 |
ClN3O3H26C27 |
AB3C3D26E27 |
-63.48 |
6.17 |
-8.68 |
-0.32 |
0 |
|
|
302323 |
124361236 |
1 |
ClN3O3C25H30 |
AB3C3D25E30 |
-113.94 |
3.14 |
-8.56 |
-0.42 |
0 |
|
|
302324 |
124361239 |
1 |
SN3O4C24H27 |
AB3C4D24E27 |
-134.57 |
5.73 |
-9.43 |
-1.19 |
0 |
|
|
302325 |
124361241 |
1 |
SN3O3C25H27 |
AB3C3D25E27 |
-67.95 |
2.39 |
-9.04 |
-0.78 |
0 |
|
|
302326 |
124361245 |
1 |
N3O4C26H33 |
A3B4C26D33 |
-158.17 |
3.98 |
-8.87 |
-0.2 |
0 |
|
|
302327 |
124361252 |
1 |
N2O7C23H24 |
A2B7C23D24 |
-257.1 |
3.52 |
-9.04 |
-0.43 |
0 |
|
|
302328 |
124361261 |
1 |
N4O5C25H32 |
A4B5C25D32 |
-204.02 |
8.19 |
-9.74 |
-0.54 |
0 |
|
|
302329 |
124361262 |
1 |
N3O4C25H31 |
A3B4C25D31 |
-151.54 |
4.41 |
-8.97 |
-0.32 |
0 |
|
|
302330 |
124361263 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-149.79 |
4.94 |
-8.85 |
-0.2 |
0 |
|
|
302331 |
124361265 |
1 |
NO7C22H25 |
AB7C22D25 |
-249.45 |
4.35 |
-9.06 |
-0.87 |
0 |
|
|
302332 |
124361268 |
1 |
SN2F3O4C21H21 |
AB2C3D4E21F21 |
-268.07 |
5.52 |
-9.14 |
-1.19 |
0 |
|
|
302333 |
124361269 |
1 |
SN2O8H16C17 |
AB2C8D16E17 |
-287.4 |
6.96 |
-9.68 |
-1.01 |
0 |
|
|
302334 |
124361270 |
1 |
NO7C25H27 |
AB7C25D27 |
-233.67 |
5.44 |
-8.85 |
-0.8 |
0 |
|
|
302335 |
124361283 |
1 |
NO2C18H19 |
AB2C18D19 |
-53.66 |
9.65 |
-9.04 |
-0.18 |
0 |
|
|
302336 |
124361297 |
1 |
N2O5C27H36 |
A2B5C27D36 |
-212.43 |
5.34 |
-9.31 |
-0.09 |
0 |
|
|
302337 |
124361312 |
1 |
N4O6C21H28 |
A4B6C21D28 |
-260.99 |
6.15 |
-9.78 |
-0.53 |
0 |
|
|
302339 |
124361326 |
2 |
O2C8H11 |
A2B8C11 |
-143.84 |
1.21 |
-8.79 |
0.3 |
0 |
|
|
302340 |
124361330 |
1 |
NS3O7C12H23 |
AB3C7D12E23 |
-324.27 |
3.85 |
-8.8 |
-0.41 |
0 |
|
|
302341 |
124361333 |
1 |
NO7C22H25 |
AB7C22D25 |
-248.59 |
4.01 |
-9.04 |
-0.88 |
0 |
|
|
302342 |
124361340 |
1 |
N2O6H16C17 |
A2B6C16D17 |
-133.56 |
6.19 |
-10.15 |
-1.55 |
0 |
|
|
302343 |
124361346 |
1 |
NO7C26H29 |
AB7C26D29 |
-209.81 |
7.75 |
-8.94 |
-1.0 |
0 |
|
|
302344 |
124361347 |
1 |
SN5O5C19H23 |
AB5C5D19E23 |
-144.42 |
5.85 |
-9.59 |
-0.65 |
0 |
|
|
302345 |
124361349 |
1 |
NO7C21H23 |
AB7C21D23 |
-247.7 |
6.04 |
-9.07 |
-0.83 |
0 |
|
|
302346 |
124361351 |
2 |
NO3C12H14 |
AB3C12D14 |
-234.81 |
5.91 |
-9.39 |
0.05 |
0 |
|
|
302347 |
124361354 |
1 |
N3O7C27H35 |
A3B7C27D35 |
-291.47 |
1.08 |
-9.46 |
0.04 |
0 |
|
|
302348 |
124361357 |
1 |
NO6C24H25 |
AB6C24D25 |
-214.03 |
5.71 |
-9.42 |
-1.04 |
0 |
|
|
302350 |
124361362 |
1 |
NO6C21H27 |
AB6C21D27 |
-256.15 |
7.44 |
-9.17 |
-0.96 |
0 |
|
|
302351 |
124361365 |
1 |
NO7H23C24 |
AB7C23D24 |
-194.51 |
5.51 |
-8.48 |
-0.66 |
0 |
|
|
302353 |
124361368 |
1 |
SN2O5C21H26 |
AB2C5D21E26 |
-169.05 |
3.64 |
-8.89 |
-0.76 |
0 |
|
|
302354 |
124361371 |
1 |
NO6C23H25 |
AB6C23D25 |
-195.83 |
8.67 |
-8.92 |
-0.76 |
0 |
|
|
302356 |
124361385 |
1 |
NPO3C16H32 |
ABC3D16E32 |
-233.81 |
2.94 |
-8.23 |
1.05 |
0 |
|
|
302357 |
124361387 |
1 |
ON2C18H20 |
AB2C18D20 |
30.12 |
1.91 |
-9.04 |
-0.36 |
0 |
|
|
302359 |
124361396 |
1 |
NO5C32H49 |
AB5C32D49 |
-241.39 |
7.2 |
-8.3 |
0.09 |
0 |
|
|
302360 |
124361418 |
1 |
N3O3H27C31 |
A3B3C27D31 |
35.37 |
5.92 |
-8.01 |
-1.22 |
0 |
|
|
302361 |
124361419 |
1 |
N3O3H27C31 |
A3B3C27D31 |
35.89 |
6.46 |
-7.96 |
-1.14 |
0 |
|
|
302362 |
124361420 |
1 |
NO5C27H45 |
AB5C27D45 |
-273.57 |
2.52 |
-9.37 |
0.7 |
0 |
|
|
302363 |
124361423 |
1 |
NO4C34H53 |
AB4C34D53 |
-222.93 |
5.06 |
-9.27 |
0.37 |
0 |
|
|
302364 |
124361427 |
1 |
N3O4C22H25 |
A3B4C22D25 |
-139.72 |
5.53 |
-8.82 |
-0.19 |
0 |
|
|
302365 |
124361432 |
1 |
FO8H17C21 |
AB8C17D21 |
-304.31 |
1.18 |
-9.41 |
-1.18 |
0 |
|
|
302366 |
124361435 |
1 |
NSO5C12H21 |
ABC5D12E21 |
-247.99 |
2.02 |
-9.17 |
-0.03 |
0 |
|
|
302368 |
124361438 |
1 |
SCl3O3N4C19H19 |
AB3C3D4E19F19 |
-77.69 |
10.4 |
-8.85 |
-0.64 |
0 |
|
|
302369 |
124361439 |
1 |
SCl3O3N4C19H19 |
AB3C3D4E19F19 |
-76.88 |
5.69 |
-8.8 |
-0.84 |
0 |
|
|
302370 |
124361456 |
1 |
NO6C23H31 |
AB6C23D31 |
-278.23 |
2.62 |
-9.24 |
-0.99 |
0 |
|
|
302371 |
124361458 |
1 |
NO6C23H31 |
AB6C23D31 |
-277.9 |
1.78 |
-9.21 |
-0.96 |
0 |
|
|
302372 |
124361482 |
1 |
NSO6C17H19 |
ABC6D17E19 |
-240.56 |
7.6 |
-8.78 |
-1.36 |
0 |
|
|
302373 |
124361486 |
1 |
NO5C21H23 |
AB5C21D23 |
-152.22 |
3.4 |
-8.68 |
-0.23 |
0 |
|
|
302374 |
124361499 |
1 |
N2O3C17H26 |
A2B3C17D26 |
-149.94 |
6.58 |
-9.47 |
0.28 |
0 |
|
|
302375 |
124361504 |
1 |
FSN4O5C26H39 |
ABC4D5E26F39 |
-298.11 |
4.53 |
-8.64 |
-0.11 |
0 |
|
|
302376 |
124361506 |
1 |
SN4O5C27H42 |
AB4C5D27E42 |
-257.76 |
5.24 |
-8.54 |
0.04 |
0 |
|
|
302377 |
124361522 |
1 |
SN3O6C26H39 |
AB3C6D26E39 |
-281.12 |
11.93 |
-9.46 |
-0.88 |
0 |
|
|
302378 |
124361526 |
1 |
S2N3O6C21H37 |
A2B3C6D21E37 |
-313.54 |
5.79 |
-8.55 |
-0.06 |
0 |
|
|
302379 |
124361529 |
1 |
N4O7C18H30 |
A4B7C18D30 |
-355.52 |
3.72 |
-9.59 |
0.06 |
0 |
|
|
302381 |
124361538 |
1 |
NO5C23H29 |
AB5C23D29 |
-226.73 |
4.79 |
-9.23 |
-0.96 |
0 |
|
|
302382 |
124361540 |
1 |
N3O7C22H31 |
A3B7C22D31 |
-320.89 |
6.09 |
-9.24 |
-0.24 |
0 |
|
|
302383 |
124361541 |
1 |
NO6C28H31 |
AB6C28D31 |
-209.76 |
9.53 |
-9.12 |
-0.93 |
0 |
|
|
302384 |
124361542 |
1 |
SN3O6C21H31 |
AB3C6D21E31 |
-265.79 |
11.94 |
-9.72 |
-0.79 |
0 |
|
|
302385 |
124361546 |
1 |
N3O6C29H37 |
A3B6C29D37 |
-254.4 |
5.11 |
-9.26 |
-0.13 |
0 |
|
|
302386 |
124361550 |
1 |
NO5C32H37 |
AB5C32D37 |
-182.51 |
4.27 |
-9.08 |
-0.89 |
0 |
|
|
302387 |
124361553 |
1 |
O3N4C27H36 |
A3B4C27D36 |
-121.84 |
3.68 |
-8.72 |
0.01 |
0 |
|
|
302388 |
124361554 |
1 |
O3N4C27H36 |
A3B4C27D36 |
-120.44 |
4.99 |
-8.8 |
-0.07 |
0 |
|
|
302389 |
124361560 |
1 |
N2O7C28H32 |
A2B7C28D32 |
-270.27 |
8.55 |
-9.38 |
-1.15 |
0 |
|
|
302390 |
124361561 |
1 |
NSO7C24H25 |
ABC7D24E25 |
-232.99 |
9.74 |
-8.95 |
-1.33 |
0 |
|
|
302391 |
124361563 |
1 |
N2O7C23H28 |
A2B7C23D28 |
-286.56 |
10.15 |
-9.28 |
-0.99 |
0 |
|
|
302392 |
124361568 |
1 |
N2O7C22H28 |
A2B7C22D28 |
-293.14 |
6.88 |
-9.33 |
-1.08 |
0 |
|
|
302393 |
124361569 |
1 |
SN4O4C23H28 |
AB4C4D23E28 |
-129.53 |
4.22 |
-8.98 |
-0.51 |
0 |
|
|
302395 |
124361571 |
1 |
NSO6C17H19 |
ABC6D17E19 |
-220.25 |
8.59 |
-9.13 |
-0.97 |
0 |
|
|
302396 |
124361572 |
1 |
NSO6C25H25 |
ABC6D25E25 |
-199.95 |
8.32 |
-9.27 |
-1.1 |
0 |
|
|
302397 |
124361575 |
4 |
NOC6H9 |
ABC6D9 |
-181.68 |
5.6 |
-8.41 |
-0.03 |
0 |
|
|
302398 |
124361577 |
4 |
NOC6H9 |
ABC6D9 |
-182.03 |
3.82 |
-8.41 |
-0.02 |
0 |
|
|
302399 |
124361578 |
1 |
N3O6H23C26 |
A3B6C23D26 |
-188.39 |
8.14 |
-8.93 |
-1.3 |
0 |