List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
293275 |
117380859 |
1 |
NO4C13H17 |
AB4C13D17 |
-125.13 |
4.99 |
-8.93 |
-0.29 |
0 |
|
|
293276 |
117380876 |
1 |
NO4C13H17 |
AB4C13D17 |
-160.95 |
8.58 |
-9.24 |
-0.8 |
0 |
|
|
293277 |
117381236 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-96.49 |
2.59 |
-9.01 |
-0.23 |
0 |
|
|
293278 |
117381251 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-127.69 |
2.04 |
-9.09 |
-0.72 |
0 |
|
|
293279 |
117381271 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-109.85 |
1.89 |
-8.68 |
0.17 |
0 |
|
|
293280 |
117381387 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-109.7 |
2.24 |
-8.73 |
-0.04 |
0 |
|
|
293281 |
117381392 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-120.09 |
1.23 |
-8.97 |
-0.26 |
0 |
|
|
293282 |
117381509 |
1 |
NO3C14H21 |
AB3C14D21 |
-108.76 |
2.83 |
-8.65 |
0.24 |
0 |
|
|
293283 |
117381539 |
1 |
NO3C14H21 |
AB3C14D21 |
-121.64 |
4.49 |
-8.63 |
0.07 |
0 |
|
|
293284 |
117381629 |
1 |
NO3C14H21 |
AB3C14D21 |
-145.31 |
2.42 |
-9.1 |
-0.14 |
0 |
|
|
293285 |
117381739 |
1 |
NO3C14H21 |
AB3C14D21 |
-91.1 |
5.77 |
-8.7 |
0.26 |
0 |
|
|
293286 |
117381921 |
1 |
NSO2C13H17 |
ABC2D13E17 |
-73.99 |
5.74 |
-9.1 |
-0.55 |
0 |
|
|
293287 |
117381958 |
1 |
NSO2C13H17 |
ABC2D13E17 |
-67.89 |
3.77 |
-8.53 |
-0.44 |
0 |
|
|
293288 |
117382178 |
1 |
NO2C15H25 |
AB2C15D25 |
-92.03 |
3.09 |
-8.27 |
0.3 |
0 |
|
|
293289 |
117382181 |
1 |
NO2C15H25 |
AB2C15D25 |
-96.4 |
1.97 |
-8.27 |
0.2 |
0 |
|
|
293290 |
117382232 |
1 |
NC18H21 |
AB18C21 |
34.71 |
2.17 |
-9.06 |
0.22 |
0 |
|
|
293291 |
117382560 |
1 |
ClON3C12H14 |
ABC3D12E14 |
9.7 |
1.98 |
-8.6 |
-0.2 |
0 |
|
|
293292 |
117382660 |
1 |
ClNO2C13H14 |
ABC2D13E14 |
-57.81 |
5.18 |
-9.12 |
-0.42 |
0 |
|
|
293293 |
117382756 |
1 |
ClNO2C13H14 |
ABC2D13E14 |
-65.4 |
2.22 |
-9.08 |
-0.86 |
0 |
|
|
293294 |
117382814 |
1 |
ClNOC14H18 |
ABCD14E18 |
-50.66 |
3.69 |
-8.73 |
-0.15 |
0 |
|
|
293295 |
117383049 |
1 |
BrON3H6C9 |
ABC3D6E9 |
33.24 |
2.14 |
-8.94 |
-0.83 |
0 |
|
|
293296 |
117383176 |
1 |
FO3N4H9C10 |
AB3C4D9E10 |
-18.14 |
3.88 |
-8.98 |
-1.52 |
0 |
|
|
293297 |
117383249 |
6 |
OC2H2 |
AB2C2 |
-196.54 |
7.46 |
-9.21 |
-1.41 |
0 |
|
|
293298 |
117383250 |
6 |
OC2H2 |
AB2C2 |
-199.35 |
5.09 |
-9.15 |
-0.86 |
0 |
|
|
293299 |
117383370 |
1 |
FN2O3C12H13 |
AB2C3D12E13 |
-77.62 |
4.6 |
-8.92 |
-0.45 |
0 |
|
|
293300 |
117383600 |
1 |
O5C13H16 |
A5B13C16 |
-179.65 |
7.35 |
-9.52 |
-0.96 |
0 |
|
|
293301 |
117383614 |
2 |
NO2C6H8 |
AB2C6D8 |
-168.74 |
5.28 |
-9.29 |
-0.32 |
0 |
|
|
293302 |
117383695 |
1 |
FO3C14H17 |
AB3C14D17 |
-143.88 |
2.99 |
-8.71 |
-0.04 |
0 |
|
|
293303 |
117383701 |
1 |
FO3C14H17 |
AB3C14D17 |
-140.39 |
1.82 |
-9.15 |
-0.31 |
0 |
|
|
293304 |
117383717 |
1 |
FO3C14H17 |
AB3C14D17 |
-151.19 |
3.11 |
-9.71 |
-0.24 |
0 |
|
|
293305 |
117383769 |
1 |
FO3C14H17 |
AB3C14D17 |
-168.6 |
2.76 |
-9.05 |
-0.17 |
0 |
|
|
293306 |
117383799 |
1 |
FO3C14H17 |
AB3C14D17 |
-176.63 |
7.78 |
-9.55 |
-0.55 |
0 |
|
|
293307 |
117383898 |
2 |
O2C7H10 |
A2B7C10 |
-171.96 |
6.97 |
-8.54 |
-0.01 |
0 |
|
|
293308 |
117383931 |
2 |
O2C7H10 |
A2B7C10 |
-153.26 |
2.76 |
-8.79 |
-0.02 |
0 |
|
|
293309 |
117383986 |
2 |
O2C7H10 |
A2B7C10 |
-182.15 |
3.8 |
-9.12 |
-0.14 |
0 |
|
|
293310 |
117384061 |
2 |
O2C7H10 |
A2B7C10 |
-169.38 |
5.81 |
-8.86 |
0.1 |
0 |
|
|
293311 |
117384142 |
1 |
O2H16C17 |
A2B16C17 |
-37.49 |
4.95 |
-9.47 |
-0.4 |
0 |
|
|
293312 |
117384146 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-49.09 |
3.93 |
-8.6 |
0.07 |
0 |
|
|
293313 |
117384153 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-108.59 |
5.57 |
-8.82 |
-0.27 |
0 |
|
|
293314 |
117384163 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-94.94 |
3.95 |
-8.63 |
0.05 |
0 |
|
|
293315 |
117384167 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-121.96 |
4.97 |
-8.58 |
0.1 |
0 |
|
|
293316 |
117384207 |
1 |
ON2C16H16 |
AB2C16D16 |
6.53 |
3.71 |
-9.24 |
-0.86 |
0 |
|
|
293317 |
117384211 |
1 |
ON2C16H16 |
AB2C16D16 |
30.07 |
3.27 |
-9.33 |
-1.0 |
0 |
|
|
293318 |
117384271 |
1 |
SO3C13H16 |
AB3C13D16 |
-103.87 |
7.41 |
-8.88 |
-0.59 |
0 |
|
|
293319 |
117384272 |
1 |
SO3C13H16 |
AB3C13D16 |
-105.28 |
4.84 |
-9.14 |
-0.59 |
0 |
|
|
293320 |
117384341 |
1 |
FON2C14H21 |
ABC2D14E21 |
-73.42 |
2.38 |
-8.6 |
0.3 |
0 |
|
|
293321 |
117384361 |
1 |
FON2C14H21 |
ABC2D14E21 |
-73.14 |
2.77 |
-8.8 |
0.06 |
0 |
|
|
293322 |
117384386 |
1 |
FON2C14H21 |
ABC2D14E21 |
-83.42 |
3.67 |
-8.68 |
-0.07 |
0 |
|
|
293323 |
117384402 |
1 |
FON2C14H21 |
ABC2D14E21 |
-65.98 |
1.86 |
-8.68 |
0.1 |
0 |
|
|
293324 |
117384415 |
1 |
FON2C14H21 |
ABC2D14E21 |
-75.91 |
1.65 |
-9.22 |
-0.1 |
0 |
|
|
293325 |
117384418 |
1 |
FON2C14H21 |
ABC2D14E21 |
-58.72 |
0.42 |
-8.7 |
0.1 |
0 |
|
|
293326 |
117384430 |
1 |
FON2C14H21 |
ABC2D14E21 |
-85.17 |
4.36 |
-8.54 |
0.18 |
0 |
|
|
293327 |
117384562 |
1 |
ClO2F3H8C10 |
AB2C3D8E10 |
-231.01 |
4.03 |
-9.85 |
-0.97 |
0 |
|
|
293328 |
117384637 |
1 |
ClN2O3H9C11 |
AB2C3D9E11 |
-45.19 |
6.37 |
-8.72 |
-1.98 |
0 |
|
|
293329 |
117384654 |
1 |
ClFSO3C9H10 |
ABCD3E9F10 |
-157.27 |
5.02 |
-9.41 |
-1.03 |
0 |
|
|
293330 |
117384671 |
1 |
ClO3C13H13 |
AB3C13D13 |
-95.82 |
4.59 |
-9.87 |
-1.32 |
0 |
|
|
293331 |
117384754 |
1 |
ClN2O2C12H13 |
AB2C2D12E13 |
-18.78 |
2.59 |
-8.69 |
-0.44 |
0 |
|
|
293332 |
117384761 |
1 |
ClN2O2C12H13 |
AB2C2D12E13 |
-10.9 |
1.12 |
-9.22 |
-0.99 |
0 |
|
|
293333 |
117384897 |
1 |
ClO2C14H17 |
AB2C14D17 |
-44.55 |
2.38 |
-8.84 |
-0.22 |
0 |
|
|
293334 |
117384950 |
1 |
ClOC15H21 |
ABC15D21 |
-58.19 |
3.36 |
-9.42 |
-0.17 |
0 |
|
|
293335 |
117384967 |
1 |
ClN2C14H21 |
AB2C14D21 |
-6.57 |
1.73 |
-8.88 |
0.12 |
0 |
|
|
293336 |
117385002 |
1 |
ClN2C14H21 |
AB2C14D21 |
17.46 |
1.51 |
-8.85 |
-0.04 |
0 |
|
|
293337 |
117385007 |
1 |
ClN2C14H21 |
AB2C14D21 |
-2.43 |
3.19 |
-8.51 |
0.02 |
0 |
|
|
293338 |
117385008 |
1 |
ClN2C14H21 |
AB2C14D21 |
2.41 |
3.46 |
-8.64 |
-0.06 |
0 |
|
|
293339 |
117385014 |
1 |
ClN2C14H21 |
AB2C14D21 |
11.39 |
2.45 |
-8.9 |
-0.02 |
0 |
|
|
293340 |
117385018 |
1 |
BNO6C10H12 |
ABC6D10E12 |
-286.6 |
4.51 |
-9.1 |
-0.65 |
0 |
|
|
293341 |
117385021 |
1 |
BrF2O2H7C8 |
AB2C2D7E8 |
-158.19 |
1.51 |
-9.59 |
-0.92 |
0 |
|
|
293342 |
117385055 |
1 |
BrOC12H13 |
ABC12D13 |
-14.45 |
3.45 |
-9.52 |
-0.25 |
0 |
|
|
293343 |
117385099 |
1 |
FNO5H8C11 |
ABC5D8E11 |
-160.15 |
6.54 |
-9.51 |
-1.52 |
0 |
|
|
293344 |
117385107 |
1 |
FNO5H8C11 |
ABC5D8E11 |
-156.96 |
6.99 |
-9.3 |
-1.52 |
0 |
|
|
293345 |
117385175 |
1 |
F2O2N3H9C11 |
A2B2C3D9E11 |
-109.62 |
4.11 |
-9.11 |
-1.11 |
0 |
|
|
293346 |
117385183 |
1 |
F2O2N3H9C11 |
A2B2C3D9E11 |
-106.59 |
9.92 |
-9.65 |
-1.37 |
0 |
|
|
293347 |
117385201 |
1 |
FNO4C12H12 |
ABC4D12E12 |
-155.45 |
2.38 |
-9.02 |
-0.69 |
0 |
|
|
293348 |
117385229 |
1 |
FN3O3C11H12 |
AB3C3D11E12 |
-69.26 |
5.56 |
-8.73 |
-0.81 |
0 |
|
|
293349 |
117385233 |
1 |
FN3O3C11H12 |
AB3C3D11E12 |
-73.09 |
4.6 |
-9.32 |
-0.37 |
0 |