List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
220267 |
85177188 |
1 |
NO2C14H25 |
AB2C14D25 |
-120.37 |
5.55 |
-9.01 |
0.88 |
0 |
|
|
220268 |
85177189 |
1 |
NC17H21 |
AB17C21 |
36.4 |
2.71 |
-9.24 |
-0.6 |
0 |
|
|
220269 |
85177191 |
1 |
ClNOC13H18 |
ABCD13E18 |
-60.56 |
4.49 |
-9.03 |
0.14 |
0 |
|
|
220270 |
85177193 |
1 |
ON2F3H7C11 |
AB2C3D7E11 |
-122.07 |
11.21 |
-8.98 |
-1.6 |
0 |
|
|
220271 |
85177194 |
1 |
O3N6C8H12 |
A3B6C8D12 |
4.49 |
5.32 |
-9.88 |
-0.41 |
0 |
|
|
220272 |
85177196 |
1 |
PO3C12H17 |
AB3C12D17 |
-157.08 |
2.6 |
-9.35 |
0.08 |
0 |
|
|
220275 |
85177208 |
1 |
ON4H12C13 |
AB4C12D13 |
70.25 |
2.48 |
-9.06 |
-1.15 |
0 |
|
|
220277 |
85177217 |
1 |
N2O2C13H25 |
A2B2C13D25 |
-73.79 |
5.27 |
0.0 |
0.0 |
0 |
|
|
220279 |
85177221 |
1 |
SiO2C13H24 |
AB2C13D24 |
-127.28 |
2.22 |
-8.68 |
0.34 |
0 |
|
|
220281 |
85177234 |
1 |
N5C13H15 |
A5B13C15 |
112.28 |
3.94 |
-8.31 |
-0.07 |
0 |
|
|
220282 |
85177239 |
1 |
N2O5C10H14 |
A2B5C10D14 |
-160.99 |
2.99 |
-9.89 |
-0.7 |
0 |
|
|
220283 |
85177241 |
1 |
O3H14C15 |
A3B14C15 |
-79.72 |
0.99 |
-9.14 |
-0.22 |
0 |
|
|
220284 |
85177245 |
1 |
O4C13H22 |
A4B13C22 |
-136.75 |
2.49 |
-8.01 |
0.52 |
0 |
|
|
220285 |
85177246 |
2 |
OC8H9 |
AB8C9 |
-20.45 |
1.94 |
-9.17 |
-0.2 |
0 |
|
|
220286 |
85177252 |
1 |
SiO2C13H26 |
AB2C13D26 |
-123.41 |
3.51 |
-8.57 |
0.64 |
0 |
|
|
220287 |
85177256 |
1 |
N3O5C9H15 |
A3B5C9D15 |
-202.07 |
3.43 |
-9.9 |
-0.25 |
0 |
|
|
220288 |
85177258 |
1 |
NO3H13C14 |
AB3C13D14 |
-61.93 |
2.19 |
-10.37 |
-1.32 |
0 |
|
|
220289 |
85177261 |
1 |
NO4C12H21 |
AB4C12D21 |
-204.94 |
3.53 |
-9.88 |
0.75 |
0 |
|
|
220290 |
85177262 |
1 |
NO2C15H17 |
AB2C15D17 |
-37.78 |
3.95 |
-9.85 |
-0.64 |
0 |
|
|
220291 |
85177263 |
1 |
NOC16H21 |
ABC16D21 |
-19.0 |
1.89 |
-8.96 |
0.33 |
0 |
|
|
220292 |
85177264 |
1 |
NOC16H21 |
ABC16D21 |
-22.28 |
1.81 |
-8.53 |
0.11 |
0 |
|
|
220293 |
85177265 |
1 |
NO2C14H29 |
AB2C14D29 |
-128.57 |
3.34 |
-8.44 |
2.39 |
0 |
|
|
220294 |
85177266 |
1 |
NC17H25 |
AB17C25 |
39.25 |
1.05 |
-8.74 |
0.44 |
0 |
|
|
220295 |
85177267 |
1 |
NC17H25 |
AB17C25 |
2.85 |
2.26 |
-9.17 |
0.55 |
0 |
|
|
220296 |
85177269 |
1 |
NOSiC13H29 |
ABCD13E29 |
-113.07 |
3.17 |
-8.71 |
1.34 |
0 |
|
|
220297 |
85177270 |
1 |
ClNH14C15 |
ABC14D15 |
26.01 |
4.11 |
-9.24 |
-0.77 |
0 |
|
|
220298 |
85177271 |
1 |
OCl2N3H7C9 |
AB2C3D7E9 |
1.71 |
3.27 |
-9.08 |
-0.95 |
0 |
|
|
220299 |
85177272 |
1 |
BrNOC10H14 |
ABCD10E14 |
-37.98 |
3.89 |
-9.32 |
-1.1 |
0 |
|
|
220300 |
85177273 |
1 |
O2F3H11C12 |
A2B3C11D12 |
-211.47 |
4.03 |
-10.48 |
-1.25 |
0 |
|
|
220301 |
85177274 |
1 |
O6C11H16 |
A6B11C16 |
-232.02 |
2.58 |
-10.23 |
-0.61 |
0 |
|
|
220302 |
85177275 |
1 |
SN2O4C9H14 |
AB2C4D9E14 |
-188.17 |
2.93 |
-9.28 |
-0.2 |
0 |
|
|
220303 |
85177276 |
1 |
SN2O2H8C12 |
AB2C2D8E12 |
27.55 |
3.38 |
-8.63 |
-1.28 |
0 |
|
|
220304 |
85177277 |
1 |
O5C12H20 |
A5B12C20 |
-228.39 |
3.32 |
-10.14 |
0.45 |
0 |
|
|
220305 |
85177278 |
1 |
O5C12H20 |
A5B12C20 |
-251.82 |
7.31 |
-10.42 |
0.82 |
0 |
|
|
220306 |
85177279 |
1 |
O5C12H20 |
A5B12C20 |
-238.5 |
2.57 |
-9.87 |
0.11 |
0 |
|
|
220307 |
85177280 |
1 |
O3C15H16 |
A3B15C16 |
-84.76 |
1.88 |
-9.03 |
-1.16 |
0 |
|
|
220308 |
85177281 |
1 |
O3C15H16 |
A3B15C16 |
-112.15 |
3.47 |
-9.06 |
-0.64 |
0 |
|
|
220309 |
85177282 |
1 |
O3C15H16 |
A3B15C16 |
-74.15 |
2.32 |
-8.62 |
-0.43 |
0 |
|
|
220310 |
85177283 |
1 |
O3C15H16 |
A3B15C16 |
-46.97 |
2.44 |
-8.96 |
-0.23 |
0 |
|
|
220312 |
85177285 |
2 |
OC8H10 |
AB8C10 |
-7.44 |
0.01 |
-9.54 |
1.08 |
0 |
|
|
220313 |
85177286 |
2 |
OC8H10 |
AB8C10 |
-35.91 |
4.33 |
-8.98 |
0.7 |
0 |
|
|
220314 |
85177287 |
2 |
OC8H10 |
AB8C10 |
-56.01 |
1.57 |
-9.34 |
-0.17 |
0 |
|
|
220315 |
85177288 |
1 |
ON2C15H20 |
AB2C15D20 |
-25.6 |
3.29 |
-8.63 |
-0.86 |
0 |
|
|
220316 |
85177289 |
1 |
OSC15H16 |
ABC15D16 |
-8.9 |
5.86 |
-8.96 |
-0.63 |
0 |
|
|
220317 |
85177290 |
1 |
OSiN2C13H16 |
ABC2D13E16 |
-1.99 |
2.9 |
-9.12 |
-0.92 |
0 |
|
|
220318 |
85177291 |
1 |
OC17H24 |
AB17C24 |
-21.06 |
1.44 |
-8.79 |
0.38 |
0 |
|
|
220320 |
85177293 |
1 |
SiO3C12H24 |
AB3C12D24 |
-203.12 |
2.47 |
-9.0 |
0.2 |
0 |
|
|
220321 |
85177294 |
1 |
ClSO2C11H13 |
ABC2D11E13 |
-46.93 |
2.3 |
-8.96 |
-0.49 |
0 |
|
|
220322 |
85177295 |
1 |
N3O5C9H15 |
A3B5C9D15 |
-161.24 |
3.88 |
-10.1 |
-0.18 |
0 |
|
|
220323 |
85177296 |
1 |
O2N5C11H11 |
A2B5C11D11 |
15.88 |
10.0 |
-8.75 |
-0.68 |
0 |
|
|
220324 |
85177297 |
1 |
NO5C11H19 |
AB5C11D19 |
-219.8 |
5.63 |
-9.84 |
0.61 |
0 |
|
|
220325 |
85177298 |
1 |
NO3C14H15 |
AB3C14D15 |
-97.12 |
5.6 |
-9.44 |
-0.31 |
0 |
|
|
220326 |
85177299 |
1 |
NO3C14H15 |
AB3C14D15 |
-13.84 |
3.63 |
-9.14 |
-0.63 |
0 |
|
|
220328 |
85177301 |
1 |
NO4C12H23 |
AB4C12D23 |
-230.53 |
5.91 |
-10.08 |
0.44 |
0 |
|
|
220329 |
85177302 |
1 |
NO2C15H19 |
AB2C15D19 |
-85.93 |
4.09 |
-9.45 |
0.14 |
0 |
|
|
220330 |
85177303 |
1 |
NO2C15H19 |
AB2C15D19 |
-28.21 |
4.53 |
-8.87 |
-0.7 |
0 |
|
|
220331 |
85177304 |
1 |
NO2C15H19 |
AB2C15D19 |
-73.15 |
4.92 |
-8.7 |
0.09 |
0 |
|
|
220332 |
85177305 |
1 |
NOC16H23 |
ABC16D23 |
-21.01 |
1.67 |
-8.75 |
0.32 |
0 |
|
|
220333 |
85177306 |
1 |
NOC16H23 |
ABC16D23 |
-10.36 |
3.02 |
-8.81 |
0.45 |
0 |
|
|
220334 |
85177307 |
1 |
ClNO2C12H20 |
ABC2D12E20 |
-142.42 |
4.0 |
-9.59 |
0.61 |
0 |
|
|
220335 |
85177308 |
1 |
ClNC14H28 |
ABC14D28 |
-27.6 |
2.73 |
-9.21 |
0.3 |
0 |
|
|
220336 |
85177309 |
1 |
OF6H8C9 |
AB6C8D9 |
-342.95 |
4.0 |
-11.02 |
-1.16 |
0 |
|
|
220337 |
85177310 |
1 |
SN2O5C8H12 |
AB2C5D8E12 |
-183.85 |
5.78 |
-9.18 |
-0.71 |
0 |
|
|
220338 |
85177311 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-89.07 |
5.02 |
-8.85 |
0.02 |
0 |
|
|
220339 |
85177312 |
1 |
ON6C11H14 |
AB6C11D14 |
61.68 |
7.46 |
-9.26 |
-0.9 |
0 |
|
|
220340 |
85177313 |
1 |
SN2O2H10C12 |
AB2C2D10E12 |
42.9 |
4.79 |
-9.23 |
-1.34 |
0 |
|
|
220341 |
85177314 |
1 |
O5C12H22 |
A5B12C22 |
-242.44 |
4.95 |
-9.9 |
0.48 |
0 |
|
|
220342 |
85177315 |
3 |
OC5H6 |
AB5C6 |
-108.33 |
2.96 |
-9.5 |
0.22 |
0 |
|
|
220343 |
85177316 |
3 |
OC5H6 |
AB5C6 |
-106.9 |
2.05 |
-9.46 |
0.26 |
0 |
|
|
220344 |
85177317 |
2 |
OC8H11 |
AB8C11 |
-99.56 |
3.29 |
-8.61 |
0.37 |
0 |
|
|
220345 |
85177318 |
2 |
OC8H11 |
AB8C11 |
-69.16 |
3.73 |
-9.0 |
0.26 |
0 |
|
|
220346 |
85177319 |
1 |
SiO4C11H22 |
AB4C11D22 |
-210.23 |
3.45 |
-9.63 |
0.25 |
0 |
|
|
220347 |
85177320 |
1 |
OC17H26 |
AB17C26 |
-11.59 |
2.88 |
-9.56 |
0.71 |
0 |
|
|
220348 |
85177321 |
1 |
ClIO2C4H4 |
ABC2D4E4 |
-59.09 |
2.39 |
-9.98 |
-1.2 |
0 |
|
|
220349 |
85177322 |
1 |
SiO2C13H30 |
AB2C13D30 |
-197.41 |
1.68 |
-8.76 |
1.35 |
0 |