List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
83182 |
49857252 |
2 |
NH5C9 |
AB5C9 |
176.04 |
1.7 |
-9.42 |
-1.27 |
0 |
|
|
83183 |
49857253 |
1 |
ClO2C11H13 |
AB2C11D13 |
-85.79 |
4.78 |
-9.74 |
-0.41 |
0 |
|
|
83184 |
49857254 |
1 |
O5C17H22 |
A5B17C22 |
-166.44 |
2.59 |
-10.0 |
-0.77 |
0 |
|
|
83185 |
49857257 |
2 |
NO3C21H36 |
AB3C21D36 |
-294.51 |
6.89 |
-8.93 |
0.76 |
0 |
|
|
83186 |
49857258 |
2 |
NOC16H26 |
ABC16D26 |
-79.83 |
3.22 |
-9.02 |
-0.11 |
0 |
|
|
83187 |
49857259 |
2 |
NOC16H26 |
ABC16D26 |
-110.16 |
4.26 |
-8.77 |
0.65 |
0 |
|
|
83188 |
49857260 |
2 |
NOC15H24 |
ABC15D24 |
-117.21 |
3.32 |
-8.71 |
0.62 |
0 |
|
|
83189 |
49857262 |
1 |
O2C9H14 |
A2B9C14 |
-104.75 |
2.75 |
-10.23 |
0.26 |
0 |
|
|
83190 |
49857263 |
1 |
BrNO3C11H14 |
ABC3D11E14 |
-105.69 |
3.18 |
-10.17 |
-0.33 |
0 |
|
|
83191 |
49857264 |
1 |
ISi2O3C34H65 |
AB2C3D34E65 |
-276.55 |
2.98 |
-8.7 |
-0.56 |
0 |
|
|
83192 |
49857265 |
1 |
PO7C27H29 |
AB7C27D29 |
-279.69 |
3.44 |
-8.77 |
-0.21 |
0 |
|
|
83193 |
49857266 |
1 |
Si2O6C49H84 |
A2B6C49D84 |
-397.2 |
2.2 |
-8.54 |
0.16 |
0 |
|
|
83194 |
49857267 |
1 |
O6C31H44 |
A6B31C44 |
-248.63 |
3.12 |
-8.78 |
0.22 |
0 |
|
|
83195 |
49857268 |
1 |
O6C31H44 |
A6B31C44 |
-258.95 |
1.53 |
-8.76 |
0.23 |
0 |
|
|
83196 |
49857269 |
1 |
NSF3H6O6C13 |
ABC3D6E6F13 |
-239.27 |
3.96 |
-9.59 |
-2.17 |
0 |
|
|
83197 |
49857270 |
1 |
BNSO4C18H18 |
ABCD4E18F18 |
-129.28 |
8.11 |
-8.56 |
-1.31 |
0 |
|
|
83198 |
49857271 |
1 |
BNO5C18H18 |
ABC5D18E18 |
-155.68 |
7.57 |
-9.28 |
-1.55 |
0 |
|
|
83199 |
49857272 |
1 |
SN4O4H18C24 |
AB4C4D18E24 |
17.29 |
2.49 |
-8.9 |
-1.54 |
0 |
|
|
83200 |
49857273 |
1 |
SN3O4H19C25 |
AB3C4D19E25 |
10.01 |
2.33 |
-9.07 |
-1.73 |
0 |
|
|
83201 |
49857274 |
1 |
SO2N3H21C25 |
AB2C3D21E25 |
9.48 |
9.11 |
-8.49 |
-0.86 |
0 |
|
|
83202 |
49857275 |
1 |
O2C21H28 |
A2B21C28 |
-87.39 |
2.81 |
-8.34 |
-0.02 |
0 |
|
|
83203 |
49857278 |
1 |
O3C21H28 |
A3B21C28 |
-109.46 |
1.65 |
-7.96 |
0.0 |
0 |
|
|
83204 |
49857279 |
2 |
O2C11H14 |
A2B11C14 |
-136.12 |
2.86 |
-8.47 |
-0.74 |
0 |
|
|
83205 |
49857280 |
4 |
OC5H6 |
AB5C6 |
-146.23 |
5.96 |
-8.6 |
-0.94 |
0 |
|
|
83206 |
49857281 |
1 |
O4C19H24 |
A4B19C24 |
-158.58 |
7.37 |
-9.32 |
-1.44 |
0 |
|
|
83207 |
49857282 |
1 |
ClFSN6H16C17 |
ABCD6E16F17 |
57.82 |
3.9 |
-8.85 |
-0.79 |
0 |
|
|
83208 |
49857283 |
1 |
ClFON8C22H26 |
ABCD8E22F26 |
16.8 |
4.44 |
-8.81 |
-0.77 |
0 |
|
|
83209 |
49857284 |
2 |
FN2H8C9 |
AB2C8D9 |
-7.34 |
2.97 |
-8.89 |
-0.34 |
0 |
|
|
83210 |
49857286 |
1 |
ON3C12H13 |
AB3C12D13 |
18.43 |
1.58 |
-8.97 |
-0.32 |
0 |
|
|
83211 |
49857287 |
2 |
N2C9H9 |
A2B9C9 |
91.3 |
1.7 |
-8.41 |
-0.36 |
0 |
|
|
83212 |
49857288 |
1 |
FN4H17C18 |
AB4C17D18 |
46.7 |
2.4 |
-8.59 |
-0.41 |
0 |
|
|
83213 |
49857289 |
1 |
N5C17H17 |
A5B17C17 |
99.15 |
0.96 |
-8.67 |
-0.41 |
0 |
|
|
83214 |
49857291 |
1 |
BClN3O4C20H25 |
ABC3D4E20F25 |
-221.71 |
5.54 |
-9.64 |
-0.66 |
0 |
|
|
83215 |
49857292 |
1 |
BClN3O4C20H25 |
ABC3D4E20F25 |
-222.4 |
2.93 |
-9.7 |
-0.72 |
0 |
|
|
83216 |
49857294 |
1 |
BN3O5C21H28 |
AB3C5D21E28 |
-253.89 |
6.09 |
-9.26 |
-0.58 |
0 |
|
|
83217 |
49857297 |
1 |
NO3C22H25 |
AB3C22D25 |
-115.47 |
2.85 |
-9.14 |
0.02 |
0 |
|
|
83218 |
49857298 |
1 |
FN3O3H14C15 |
AB3C3D14E15 |
-107.34 |
5.3 |
-10.04 |
-1.41 |
0 |
|
|
83219 |
49857300 |
1 |
NO5C16H23 |
AB5C16D23 |
-217.13 |
3.86 |
-9.27 |
-0.24 |
0 |
|
|
83220 |
49857301 |
1 |
FNO3C17H22 |
ABC3D17E22 |
-183.11 |
5.19 |
-9.94 |
-0.38 |
0 |
|
|
83221 |
49857302 |
1 |
BClN2O4C35H40 |
ABC2D4E35F40 |
-202.34 |
2.34 |
-9.07 |
-0.4 |
0 |
|
|
83222 |
49857303 |
1 |
BClFN2O4C34H37 |
ABCD2E4F34G37 |
-240.78 |
0.91 |
-9.49 |
-0.45 |
0 |
|
|
83223 |
49857304 |
1 |
BClN2O4C34H44 |
ABC2D4E34F44 |
-123.88 |
4.52 |
-6.17 |
-0.82 |
0 |
|
|
83224 |
49857307 |
1 |
SiO2C23H46 |
AB2C23D46 |
-229.04 |
1.49 |
-8.72 |
1.4 |
0 |
|
|
83225 |
49857308 |
1 |
SiO2C23H46 |
AB2C23D46 |
-229.48 |
2.35 |
-8.73 |
1.38 |
0 |
|
|
83226 |
49857312 |
1 |
SiO2C23H44 |
AB2C23D44 |
-216.03 |
3.1 |
-8.77 |
0.85 |
0 |
|
|
83227 |
49857313 |
1 |
O2N5F6H17C19 |
A2B5C6D17E19 |
-280.66 |
2.14 |
-9.39 |
-1.39 |
0 |
|
|
83228 |
49857314 |
1 |
O3N5C23H23 |
A3B5C23D23 |
34.26 |
5.83 |
-9.05 |
-0.87 |
0 |
|
|
83229 |
49857315 |
1 |
O2N5C23H23 |
A2B5C23D23 |
63.6 |
7.15 |
-9.14 |
-0.78 |
0 |
|
|
83230 |
49857316 |
2 |
ON3C10H10 |
AB3C10D10 |
68.84 |
7.28 |
-9.22 |
-0.89 |
0 |
|
|
83231 |
49857319 |
1 |
F2N2H12C19 |
A2B2C12D19 |
45.86 |
5.04 |
-8.52 |
-0.99 |
0 |
|
|
83232 |
49857320 |
1 |
ON2H16C20 |
AB2C16D20 |
99.38 |
2.12 |
-8.88 |
-0.66 |
0 |
|
|
83233 |
49857321 |
1 |
ON2H16C20 |
AB2C16D20 |
98.88 |
2.51 |
-8.08 |
-0.78 |
0 |
|
|
83234 |
49857326 |
2 |
NOC9H9 |
ABC9D9 |
0.07 |
2.84 |
-8.69 |
-0.8 |
0 |
|
|
83235 |
49857329 |
1 |
O2N7H21C23 |
A2B7C21D23 |
97.7 |
6.15 |
-8.75 |
-0.55 |
0 |
|
|
83236 |
49857330 |
1 |
ON7C21H21 |
AB7C21D21 |
56.66 |
1.77 |
-8.39 |
-0.38 |
0 |
|
|
83237 |
49857332 |
1 |
O3N5H21C22 |
A3B5C21D22 |
-41.95 |
8.79 |
-9.79 |
-0.62 |
0 |
|
|
83238 |
49857333 |
2 |
OC7H8 |
AB7C8 |
-42.19 |
0.61 |
-8.06 |
-0.4 |
0 |
|
|
83239 |
49857335 |
1 |
FOC13H13 |
ABC13D13 |
-53.42 |
3.31 |
-8.67 |
-0.49 |
0 |
|
|
83240 |
49857337 |
1 |
O2C15H16 |
A2B15C16 |
-49.87 |
1.8 |
-8.32 |
-0.43 |
0 |
|
|
83241 |
49857339 |
1 |
NO2C18H23 |
AB2C18D23 |
-50.64 |
1.31 |
-8.39 |
-0.35 |
0 |
|
|
83242 |
49857341 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-32.38 |
3.79 |
-8.99 |
-0.43 |
0 |
|
|
83243 |
49857342 |
1 |
SN5O9C40H47 |
AB5C9D40E47 |
-278.36 |
4.9 |
-9.07 |
-1.06 |
0 |
|
|
83244 |
49857343 |
1 |
SF2N5O9C39H45 |
AB2C5D9E39F45 |
-395.21 |
4.19 |
-9.12 |
-0.94 |
0 |
|
|
83245 |
49857346 |
1 |
SN5O9C40H49 |
AB5C9D40E49 |
-308.14 |
7.52 |
-8.84 |
-0.83 |
0 |
|
|
83246 |
49857349 |
2 |
O5N9C25H37 |
A5B9C25D37 |
-379.82 |
8.89 |
-8.36 |
-0.14 |
0 |
|
|
83251 |
49857354 |
1 |
OPN2H30C39 |
ABC2D30E39 |
164.82 |
5.07 |
0.0 |
0.0 |
0 |
|
|
83252 |
49857355 |
1 |
BClO2C12H24 |
ABC2D12E24 |
-221.69 |
3.96 |
-10.02 |
0.91 |
0 |
|
|
83253 |
49857356 |
1 |
BClFO2C14H19 |
ABCD2E14F19 |
-219.41 |
2.84 |
-9.32 |
-0.15 |
0 |
|
|
83254 |
49857357 |
1 |
BClO2C11H20 |
ABC2D11E20 |
-190.91 |
3.97 |
-9.37 |
0.45 |
0 |
|
|
83255 |
49857358 |
1 |
BClO2C12H22 |
ABC2D12E22 |
-196.24 |
4.07 |
-9.38 |
0.47 |
0 |
|
|
83256 |
49857359 |
1 |
ON7C25H27 |
AB7C25D27 |
64.6 |
4.17 |
-8.8 |
-0.9 |
0 |
|
|
83257 |
49857360 |
1 |
N8O10C39H48 |
A8B10C39D48 |
-310.01 |
5.04 |
-9.0 |
-0.91 |
0 |
|
|
83258 |
49857361 |
1 |
O7N9C37H47 |
A7B9C37D47 |
-204.43 |
5.67 |
-8.34 |
-0.56 |
0 |
|
|
83259 |
49857363 |
1 |
N6O14C85H164 |
A6B14C85D164 |
-880.19 |
5.44 |
-9.37 |
0.08 |
0 |
|
|
83260 |
49857365 |
1 |
NO6C9H17 |
AB6C9D17 |
-287.24 |
3.47 |
-10.14 |
0.08 |
0 |
|
|
83261 |
49857366 |
1 |
NSO7C8H17 |
ABC7D8E17 |
-324.2 |
2.58 |
-10.08 |
0.1 |
0 |
|
|
83262 |
49857368 |
1 |
O5N8C42H42 |
A5B8C42D42 |
-56.65 |
7.1 |
-8.63 |
-0.61 |
0 |
|
|
83263 |
49857369 |
1 |
O6N9C49H55 |
A6B9C49D55 |
-146.4 |
2.85 |
-8.65 |
-0.42 |
0 |
|
|
83264 |
49857370 |
1 |
O4N10C43H46 |
A4B10C43D46 |
-9.75 |
3.79 |
-8.59 |
-0.47 |
0 |
|
|
83265 |
49857371 |
1 |
O2S2N5C21H23 |
A2B2C5D21E23 |
28.71 |
6.59 |
-8.54 |
-0.76 |
0 |
|
|
83266 |
49857372 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-80.44 |
2.47 |
-8.62 |
-0.53 |
0 |
|
|
83267 |
49857373 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-82.09 |
4.21 |
-8.7 |
-0.65 |
0 |
|
|
83268 |
49857374 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-63.34 |
3.37 |
-8.72 |
-0.75 |
0 |
|
|
83269 |
49857375 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-61.95 |
3.68 |
-8.67 |
-0.63 |
0 |
|
|
83270 |
49857376 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-72.25 |
5.4 |
-8.73 |
-0.71 |
0 |
|
|
83271 |
49857377 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-59.88 |
4.2 |
-8.6 |
-0.51 |
0 |
|
|
83272 |
49857378 |
1 |
N2O23C60H110 |
A2B23C60D110 |
-1168.09 |
5.19 |
-9.71 |
0.13 |
0 |
|
|
83273 |
49857381 |
1 |
SO5C10H10 |
AB5C10D10 |
-165.98 |
6.07 |
-9.4 |
-0.88 |
0 |
|
|
83276 |
49857388 |
1 |
OF4N6H26C28 |
AB4C6D26E28 |
-85.41 |
4.84 |
-9.25 |
-1.11 |
0 |
|
|
83277 |
49857389 |
1 |
OF2N6C29H30 |
AB2C6D29E30 |
3.37 |
4.44 |
-9.17 |
-1.05 |
0 |
|
|
83278 |
49857391 |
1 |
O3F5N6H29C31 |
A3B5C6D29E31 |
-200.44 |
5.2 |
-9.2 |
-1.07 |
0 |
|
|
83279 |
49857392 |
1 |
OF2N6H28C29 |
AB2C6D28E29 |
33.22 |
3.95 |
-9.22 |
-1.09 |
0 |
|
|
83280 |
49857394 |
1 |
FSO2N5H18C22 |
ABC2D5E18F22 |
22.12 |
5.7 |
-9.08 |
-1.56 |
0 |
|
|
83281 |
49857395 |
1 |
SO2N6H18C21 |
AB2C6D18E21 |
84.47 |
7.38 |
-8.67 |
-1.38 |
0 |
|
|
83282 |
49857397 |
1 |
SO2N6H20C23 |
AB2C6D20E23 |
88.01 |
6.54 |
-9.04 |
-1.56 |
0 |
|
|
83283 |
49857399 |
1 |
F2S2O3N4C18H20 |
A2B2C3D4E18F20 |
-183.56 |
6.11 |
-9.16 |
-1.2 |
0 |
|
|
83284 |
49857400 |
1 |
FS2O4N5C22H30 |
AB2C4D5E22F30 |
-200.95 |
9.26 |
-9.21 |
-0.72 |
0 |
|
|
83285 |
49857401 |
1 |
FS2O4N5C23H32 |
AB2C4D5E23F32 |
-207.75 |
7.25 |
-9.05 |
-1.3 |
0 |
|
|
83286 |
49857403 |
1 |
S2O4N5C22H31 |
A2B4C5D22E31 |
-161.34 |
7.74 |
-8.88 |
-1.05 |
0 |
|
|
83287 |
49857404 |
1 |
SO2N5C18H21 |
AB2C5D18E21 |
-4.62 |
5.02 |
-9.27 |
-1.28 |
0 |