List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
4312 |
11184 |
1 |
NiC2N2 |
AB2C2 |
121.81 |
6.31 |
-9.94 |
-1.84 |
0 |
|
|
4313 |
11186 |
1 |
ZnC2N2 |
AB2C2 |
90.41 |
0.01 |
-11.53 |
-0.69 |
0 |
|
|
4314 |
11188 |
1 |
O4C7H14 |
A4B7C14 |
-200.97 |
3.11 |
-10.37 |
0.43 |
0 |
|
|
4315 |
11190 |
2 |
CNOH2 |
ABCD2 |
19.97 |
3.75 |
-9.14 |
-1.22 |
0 |
|
|
4316 |
11191 |
1 |
OC5H10 |
AB5C10 |
-35.32 |
1.73 |
-9.68 |
1.12 |
0 |
|
|
4317 |
11192 |
1 |
ZnC4O4H6 |
AB4C4D6 |
-200.65 |
0.14 |
-11.48 |
-0.73 |
0 |
|
|
4318 |
11193 |
1 |
IC8H17 |
AB8C17 |
-31.05 |
2.68 |
-9.58 |
-0.65 |
0 |
|
|
4319 |
11199 |
1 |
OC2H4 |
AB2C4 |
-33.24 |
0.82 |
-9.78 |
0.97 |
0 |
|
|
4321 |
11202 |
1 |
BrC3H5 |
AB3C5 |
5.12 |
1.91 |
-10.04 |
0.01 |
0 |
|
|
4322 |
11203 |
1 |
ClC3H5 |
AB3C5 |
-7.34 |
1.94 |
-10.0 |
0.68 |
0 |
|
|
4323 |
11205 |
1 |
CBr4 |
AB4 |
23.07 |
0.0 |
-10.93 |
-2.03 |
0 |
|
|
4324 |
11207 |
1 |
CFSO2H3 |
ABCD2E3 |
-138.18 |
5.03 |
-12.09 |
0.04 |
0 |
|
|
4325 |
11208 |
1 |
OC4H8 |
AB4C8 |
-29.05 |
2.62 |
-10.08 |
2.22 |
0 |
|
|
4326 |
11209 |
1 |
NPC4F6H12 |
ABC4D6E12 |
-464.52 |
18.57 |
-11.78 |
-0.95 |
0 |
|
|
4327 |
11210 |
6 |
CH2 |
AB2 |
-10.32 |
0.5 |
-10.05 |
1.35 |
0 |
|
|
4328 |
11211 |
1 |
O2H5C10F13 |
A2B5C10D13 |
-714.69 |
3.04 |
-11.54 |
-0.77 |
0 |
|
|
4329 |
11215 |
2 |
C4H9 |
A4B9 |
-45.02 |
0.06 |
-10.53 |
4.12 |
0 |
|
|
4330 |
11216 |
8 |
CH2 |
AB2 |
-21.99 |
0.89 |
-9.56 |
1.55 |
0 |
|
|
4331 |
11217 |
1 |
NO12C39H61 |
AB12C39D61 |
-622.49 |
1.94 |
-8.96 |
0.45 |
0 |
|
|
4332 |
11219 |
1 |
O6C23H34 |
A6B23C34 |
-292.67 |
7.3 |
-10.12 |
-0.5 |
0 |
|
|
4333 |
11220 |
1 |
BrCN3O6 |
ABC3D6 |
-2.11 |
2.27 |
-12.07 |
-2.9 |
0 |
|
|
4334 |
11224 |
1 |
N2O5C21H28 |
A2B5C21D28 |
-183.32 |
9.53 |
-9.14 |
-0.68 |
0 |
|
|
4335 |
11227 |
1 |
NP2O5C9H23 |
AB2C5D9E23 |
-340.75 |
5.48 |
-9.22 |
0.6 |
0 |
|
|
4336 |
11229 |
1 |
C7H16 |
A7B16 |
-41.11 |
0.01 |
-10.75 |
4.18 |
0 |
|
|
4337 |
11231 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-102.11 |
4.14 |
-10.74 |
-0.22 |
0 |
|
|
4338 |
11234 |
1 |
NPO6C8H20 |
ABC6D8E20 |
-331.45 |
12.24 |
-9.52 |
-0.34 |
0 |
|
|
4339 |
11236 |
1 |
CClON3H6 |
ABCD3E6 |
-65.63 |
6.29 |
-10.6 |
0.12 |
0 |
|
|
4340 |
11239 |
5 |
CH2 |
AB2 |
-4.64 |
0.55 |
-10.1 |
1.3 |
0 |
|
|
4341 |
11241 |
1 |
ClC4H7 |
AB4C7 |
-10.22 |
1.85 |
-10.14 |
0.32 |
0 |
|
|
4342 |
11250 |
6 |
CH2 |
AB2 |
-19.59 |
0.06 |
-8.69 |
1.77 |
0 |
|
|
4343 |
11251 |
1 |
OC5H10 |
AB5C10 |
-62.55 |
3.63 |
-9.93 |
0.74 |
0 |
|
|
4344 |
11252 |
1 |
ClOC4H9 |
ABC4D9 |
-81.69 |
1.68 |
-10.48 |
0.66 |
0 |
|
|
4345 |
11253 |
1 |
BrNC2O2H4 |
ABC2D2E4 |
-24.62 |
4.08 |
-11.14 |
-1.55 |
0 |
|
|
4346 |
11256 |
2 |
NO4C11H12 |
AB4C11D12 |
-308.64 |
4.92 |
-8.97 |
-1.05 |
0 |
|
|
4347 |
11258 |
1 |
FS2C10H11 |
AB2C10D11 |
-30.44 |
2.13 |
-9.03 |
-0.26 |
0 |
|
|
4348 |
11261 |
1 |
OC6H14 |
AB6C14 |
-80.44 |
2.06 |
-10.24 |
3.01 |
0 |
|
|
4349 |
11264 |
1 |
OC6H14 |
AB6C14 |
-80.21 |
1.95 |
-10.18 |
2.89 |
0 |
|
|
4350 |
11268 |
1 |
BrO2C5H9 |
AB2C5D9 |
-105.84 |
4.02 |
-10.98 |
-1.07 |
0 |
|
|
4351 |
11269 |
2 |
C4H9 |
A4B9 |
-44.99 |
0.05 |
-10.63 |
4.09 |
0 |
|
|
4352 |
11271 |
1 |
OC7H14 |
AB7C14 |
-70.22 |
2.9 |
-9.61 |
0.78 |
0 |
|
|
4353 |
11272 |
1 |
O4C21H32 |
A4B21C32 |
-215.58 |
5.68 |
-9.71 |
-0.18 |
0 |
|
|
4354 |
11274 |
1 |
O3C20H32 |
A3B20C32 |
-186.39 |
4.81 |
-10.07 |
0.4 |
0 |
|
|
4355 |
11275 |
2 |
OC10H16 |
AB10C16 |
-128.95 |
3.46 |
-9.44 |
1.1 |
0 |
|
|
4356 |
11276 |
1 |
O4C23H34 |
A4B23C34 |
-216.78 |
2.94 |
-9.38 |
0.31 |
0 |
|
|
4357 |
11281 |
1 |
NO3C19H21 |
AB3C19D21 |
-73.83 |
2.61 |
-7.95 |
-0.21 |
0 |
|
|
4358 |
11282 |
1 |
ClNO3C26H30 |
ABC3D26E30 |
-73.15 |
2.31 |
-8.22 |
0.12 |
0 |
|
|
4359 |
11284 |
1 |
OH16C20 |
AB16C20 |
27.28 |
1.9 |
-8.18 |
-0.85 |
0 |
|
|
4360 |
11285 |
1 |
OH16C20 |
AB16C20 |
24.08 |
2.64 |
-8.31 |
-0.97 |
0 |
|
|
4361 |
11286 |
1 |
O3N4C9H12 |
A3B4C9D12 |
-86.46 |
4.53 |
-8.91 |
-0.4 |
0 |
|
|
4362 |
11287 |
12 |
CH |
AB |
25.9 |
1.49 |
-8.44 |
-0.17 |
0 |