List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
351285 |
127280173 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-152.41 |
7.42 |
-9.12 |
0.49 |
0 |
|
|
351286 |
127280174 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-63.15 |
5.29 |
-9.1 |
0.6 |
0 |
|
|
351287 |
127280175 |
2 |
ON2C10H15 |
AB2C10D15 |
-73.24 |
8.01 |
-8.96 |
-0.52 |
0 |
|
|
351288 |
127280176 |
2 |
ON3C10H14 |
AB3C10D14 |
-18.49 |
3.14 |
-8.78 |
-1.25 |
0 |
|
|
351289 |
127280177 |
1 |
O3N4C20H30 |
A3B4C20D30 |
-61.72 |
0.86 |
-8.97 |
-0.36 |
0 |
|
|
351290 |
127280178 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-93.61 |
7.58 |
-9.06 |
-0.28 |
0 |
|
|
351291 |
127280179 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-40.27 |
6.6 |
-9.02 |
-0.8 |
0 |
|
|
351292 |
127280180 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-54.38 |
7.56 |
-9.14 |
-1.21 |
0 |
|
|
351293 |
127280181 |
1 |
O2N7C20H29 |
A2B7C20D29 |
-8.23 |
5.56 |
-8.97 |
-1.2 |
0 |
|
|
351294 |
127280182 |
1 |
SO2N4C19H30 |
AB2C4D19E30 |
-81.45 |
3.59 |
-8.88 |
-0.7 |
0 |
|
|
351295 |
127280183 |
1 |
O2N5C21H35 |
A2B5C21D35 |
-85.77 |
5.34 |
-8.62 |
0.92 |
0 |
|
|
351296 |
127280184 |
2 |
ON3C9H15 |
AB3C9D15 |
-54.12 |
6.37 |
-9.21 |
0.11 |
0 |
|
|
351297 |
127280185 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-125.02 |
3.76 |
-8.69 |
0.1 |
0 |
|
|
351298 |
127280186 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-52.31 |
2.12 |
-8.47 |
-0.7 |
0 |
|
|
351299 |
127280187 |
1 |
O3N5C20H31 |
A3B5C20D31 |
-112.76 |
3.14 |
-8.89 |
-1.13 |
0 |
|
|
351300 |
127280188 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-58.06 |
7.49 |
-9.07 |
-0.65 |
0 |
|
|
351301 |
127280189 |
1 |
O2N5C20H33 |
A2B5C20D33 |
-77.57 |
3.72 |
-8.98 |
0.41 |
0 |
|
|
351302 |
127280190 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-55.85 |
4.56 |
-9.07 |
0.31 |
0 |
|
|
351303 |
127280191 |
2 |
ON3C10H14 |
AB3C10D14 |
-14.55 |
4.17 |
-8.95 |
-1.1 |
0 |
|
|
351304 |
127280192 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-40.58 |
3.38 |
-8.72 |
-0.9 |
0 |
|
|
351305 |
127280193 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-30.92 |
4.97 |
-9.13 |
-1.25 |
0 |
|
|
351306 |
127280194 |
1 |
O4N5C19H29 |
A4B5C19D29 |
-175.91 |
4.65 |
-9.24 |
-0.67 |
0 |
|
|
351307 |
127280195 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-124.12 |
4.41 |
-8.82 |
0.25 |
0 |
|
|
351308 |
127280196 |
1 |
SO2N5C18H29 |
AB2C5D18E29 |
-53.57 |
7.41 |
-8.97 |
-1.1 |
0 |
|
|
351309 |
127280197 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-113.02 |
4.03 |
-8.87 |
0.19 |
0 |
|
|
351310 |
127280198 |
1 |
O4N5C19H31 |
A4B5C19D31 |
-179.04 |
4.66 |
-8.85 |
-0.16 |
0 |
|
|
351311 |
127280199 |
1 |
O2N7C16H27 |
A2B7C16D27 |
-18.79 |
9.69 |
-9.46 |
-0.36 |
0 |
|
|
351312 |
127280200 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-165.13 |
6.72 |
-9.08 |
0.64 |
0 |
|
|
351313 |
127280201 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-68.39 |
5.58 |
-9.01 |
-0.76 |
0 |
|
|
351314 |
127280202 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-94.46 |
6.12 |
-8.99 |
-0.28 |
0 |
|
|
351315 |
127280203 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-102.34 |
5.46 |
-8.99 |
-0.2 |
0 |
|
|
351316 |
127280204 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-108.78 |
5.32 |
-8.97 |
-0.12 |
0 |
|
|
351317 |
127280205 |
4 |
NOC5H8 |
ABC5D8 |
-197.84 |
7.95 |
-8.94 |
-0.18 |
0 |
|
|
351318 |
127280206 |
1 |
SN3O4C19H33 |
AB3C4D19E33 |
-199.96 |
9.2 |
-9.18 |
0.62 |
0 |
|
|
351319 |
127280207 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-152.88 |
4.48 |
-8.85 |
0.43 |
0 |
|
|
351320 |
127280208 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-134.63 |
7.19 |
-8.96 |
-0.06 |
0 |
|
|
351321 |
127280209 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-47.5 |
6.36 |
-9.09 |
-1.08 |
0 |
|
|
351322 |
127280210 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-46.65 |
4.34 |
-8.86 |
-0.97 |
0 |
|
|
351323 |
127280211 |
1 |
N3O3C19H33 |
A3B3C19D33 |
-156.68 |
4.8 |
-8.99 |
0.8 |
0 |
|
|
351324 |
127280212 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-95.77 |
5.95 |
-9.15 |
-1.11 |
0 |
|
|
351325 |
127280213 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-148.13 |
8.3 |
-9.23 |
0.46 |
0 |
|
|
351326 |
127280214 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-33.52 |
4.05 |
-8.69 |
-0.52 |
0 |
|
|
351327 |
127280215 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-60.44 |
3.48 |
-8.96 |
-0.9 |
0 |
|
|
351328 |
127280216 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-47.31 |
2.37 |
-8.9 |
-0.95 |
0 |
|
|
351329 |
127280217 |
1 |
SO2N4C20H30 |
AB2C4D20E30 |
-66.01 |
6.75 |
-8.83 |
-0.25 |
0 |
|
|
351330 |
127280218 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-107.22 |
5.53 |
-9.01 |
0.26 |
0 |
|
|
351331 |
127280219 |
1 |
O3N4C20H30 |
A3B4C20D30 |
-122.94 |
4.2 |
-9.01 |
-0.5 |
0 |
|
|
351332 |
127280220 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-149.98 |
6.56 |
-8.81 |
0.9 |
0 |
|
|
351333 |
127280221 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-33.78 |
4.24 |
-9.04 |
-1.26 |
0 |
|
|
351334 |
127280222 |
1 |
O3N5C19H29 |
A3B5C19D29 |
-96.4 |
6.33 |
-9.07 |
-1.01 |
0 |
|
|
351335 |
127280223 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-69.14 |
1.97 |
-8.64 |
-0.28 |
0 |
|
|
351336 |
127280224 |
2 |
SN2O2C7H9 |
AB2C2D7E9 |
-94.15 |
6.54 |
-9.3 |
-1.19 |
0 |
|
|
351337 |
127280225 |
1 |
SO2N4C14H22 |
AB2C4D14E22 |
-75.2 |
7.05 |
-8.98 |
-0.13 |
0 |
|
|
351338 |
127280226 |
1 |
SN4O4C17H22 |
AB4C4D17E22 |
-117.53 |
5.12 |
-9.28 |
-0.86 |
0 |
|
|
351339 |
127280227 |
1 |
BrO2N5C16H20 |
AB2C5D16E20 |
23.6 |
4.16 |
-9.34 |
-0.2 |
0 |
|
|
351340 |
127280228 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-106.4 |
3.2 |
-8.82 |
-0.14 |
0 |
|
|
351341 |
127280229 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-115.94 |
4.62 |
-9.34 |
-0.08 |
0 |
|
|
351342 |
127280230 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-116.48 |
1.92 |
-9.37 |
-0.12 |
0 |
|
|
351343 |
127280231 |
1 |
O3N6C18H26 |
A3B6C18D26 |
-43.24 |
1.62 |
-9.24 |
-0.21 |
0 |
|
|
351344 |
127280232 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-122.76 |
2.09 |
-9.39 |
-0.12 |
0 |
|
|
351345 |
127280233 |
1 |
SO2N5C18H27 |
AB2C5D18E27 |
-26.29 |
1.68 |
-8.23 |
-0.3 |
0 |
|
|
351346 |
127280234 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-108.47 |
2.59 |
-9.45 |
-0.17 |
0 |
|
|
351347 |
127280235 |
1 |
SO2N7C15H17 |
AB2C7D15E17 |
59.11 |
2.81 |
-9.38 |
-1.37 |
0 |
|
|
351348 |
127280236 |
2 |
ON3C6H8 |
AB3C6D8 |
26.58 |
4.02 |
-9.58 |
-0.36 |
0 |
|
|
351349 |
127280237 |
2 |
ON2C11H14 |
AB2C11D14 |
-14.4 |
5.78 |
-8.5 |
-0.39 |
0 |
|
|
351350 |
127280238 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-110.13 |
2.06 |
-9.39 |
-0.12 |
0 |
|
|
351351 |
127280239 |
1 |
ClFO2N4C18H18 |
ABC2D4E18F18 |
-45.85 |
3.62 |
-8.78 |
-0.67 |
0 |
|
|
351352 |
127280240 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-39.31 |
6.8 |
-9.32 |
-0.49 |
0 |
|
|
351353 |
127280241 |
2 |
ClON2C9H9 |
ABC2D9E9 |
-12.39 |
4.46 |
-8.76 |
-0.64 |
0 |
|
|
351354 |
127280242 |
2 |
ClON2C9H9 |
ABC2D9E9 |
-13.22 |
4.3 |
-8.69 |
-0.6 |
0 |
|
|
351355 |
127280243 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-36.84 |
6.2 |
-8.89 |
-0.6 |
0 |
|
|
351356 |
127280244 |
1 |
O3N5C15H19 |
A3B5C15D19 |
-48.92 |
2.84 |
-9.48 |
-0.76 |
0 |
|
|
351357 |
127280245 |
2 |
ON2C11H14 |
AB2C11D14 |
-20.12 |
2.93 |
-8.39 |
-0.32 |
0 |
|
|
351358 |
127280246 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-102.47 |
4.47 |
-8.51 |
-0.2 |
0 |
|
|
351359 |
127280247 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-26.98 |
3.71 |
-9.22 |
-0.33 |
0 |
|
|
351360 |
127280248 |
1 |
O2N5C17H19 |
A2B5C17D19 |
24.85 |
4.55 |
-8.93 |
-0.57 |
0 |
|
|
351361 |
127280249 |
1 |
O2N7C17H19 |
A2B7C17D19 |
56.68 |
3.68 |
-9.57 |
-1.22 |
0 |
|
|
351362 |
127280250 |
2 |
ON3C7H10 |
AB3C7D10 |
7.86 |
3.96 |
-9.56 |
-0.39 |
0 |
|
|
351363 |
127280251 |
2 |
ON2C10H11 |
AB2C10D11 |
4.97 |
3.86 |
-9.01 |
-0.74 |
0 |
|
|
351364 |
127280252 |
1 |
SN4O4C18H24 |
AB4C4D18E24 |
-90.45 |
5.23 |
-9.14 |
-0.58 |
0 |
|
|
351365 |
127280253 |
1 |
O2N3C22H23 |
A2B3C22D23 |
1.22 |
4.05 |
-8.68 |
-0.36 |
0 |
|
|
351366 |
127280254 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-86.62 |
7.72 |
-9.07 |
-0.1 |
0 |
|
|
351367 |
127280255 |
1 |
ClO2N3C21H26 |
AB2C3D21E26 |
-33.23 |
2.85 |
-9.1 |
-0.21 |
0 |
|
|
351368 |
127280256 |
1 |
O4N5C15H21 |
A4B5C15D21 |
-116.56 |
4.85 |
-9.22 |
-0.14 |
0 |
|
|
351369 |
127280257 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-23.09 |
5.87 |
-8.28 |
-0.33 |
0 |
|
|
351370 |
127280258 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-18.67 |
5.87 |
-9.19 |
-0.73 |
0 |
|
|
351371 |
127280259 |
1 |
N4O4C19H22 |
A4B4C19D22 |
-106.65 |
7.44 |
-9.06 |
-0.88 |
0 |
|
|
351372 |
127280260 |
1 |
SO2N4C20H26 |
AB2C4D20E26 |
-33.01 |
11.08 |
-8.63 |
-0.19 |
0 |
|
|
351373 |
127280261 |
1 |
ON4C16H22 |
AB4C16D22 |
3.7 |
5.2 |
-8.85 |
-0.7 |
0 |
|
|
351374 |
127280262 |
1 |
S2N3O3C16H25 |
A2B3C3D16E25 |
-97.47 |
3.86 |
-8.81 |
-0.87 |
0 |
|
|
351375 |
127280263 |
1 |
SO3N5C14H25 |
AB3C5D14E25 |
-100.48 |
8.98 |
-9.03 |
0.35 |
0 |
|
|
351376 |
127280264 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-132.04 |
3.17 |
-8.87 |
-0.25 |
0 |
|
|
351377 |
127280265 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-109.2 |
8.33 |
-9.18 |
-0.23 |
0 |
|
|
351378 |
127280266 |
1 |
SO3N5C18H31 |
AB3C5D18E31 |
-112.16 |
10.01 |
-8.8 |
0.16 |
0 |
|
|
351379 |
127280267 |
1 |
SN3O3C13H25 |
AB3C3D13E25 |
-137.19 |
1.77 |
-8.73 |
0.47 |
0 |
|
|
351380 |
127280268 |
1 |
SN3O3C12H23 |
AB3C3D12E23 |
-130.88 |
3.15 |
-8.9 |
0.18 |
0 |
|
|
351381 |
127280269 |
1 |
S2N3O3C17H27 |
A2B3C3D17E27 |
-101.97 |
7.16 |
-8.78 |
-1.04 |
0 |
|
|
351382 |
127280270 |
1 |
ON6C17H26 |
AB6C17D26 |
20.33 |
1.84 |
-8.7 |
0.28 |
0 |
|
|
351383 |
127280271 |
1 |
S2N3O4C16H25 |
A2B3C4D16E25 |
-129.13 |
8.62 |
-9.35 |
-1.16 |
0 |
|
|
351384 |
127280272 |
1 |
SO3N4C15H24 |
AB3C4D15E24 |
-88.09 |
6.49 |
-9.1 |
-1.27 |
0 |