List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
339404 |
127261300 |
2 |
O2C10H11 |
A2B10C11 |
-105.2 |
3.31 |
-8.76 |
-0.17 |
0 |
|
|
339405 |
127261301 |
1 |
NO2C16H25 |
AB2C16D25 |
-62.32 |
2.27 |
-8.14 |
0.33 |
0 |
|
|
339406 |
127261302 |
1 |
NO3H21C22 |
AB3C21D22 |
-3.65 |
1.74 |
-8.81 |
-0.04 |
0 |
|
|
339407 |
127261303 |
1 |
NO4C13H17 |
AB4C13D17 |
-69.35 |
4.92 |
-8.4 |
0.17 |
0 |
|
|
339408 |
127261304 |
1 |
NO4C17H19 |
AB4C17D19 |
-59.33 |
5.21 |
-8.43 |
0.13 |
0 |
|
|
339409 |
127261305 |
1 |
OC15H24 |
AB15C24 |
-64.56 |
3.31 |
-9.19 |
0.74 |
0 |
|
|
339410 |
127261306 |
1 |
SO3C11H12 |
AB3C11D12 |
-88.17 |
6.96 |
-10.07 |
-1.17 |
0 |
|
|
339411 |
127261307 |
1 |
INOPH25C27 |
ABCDE25F27 |
35.6 |
3.9 |
-8.14 |
-0.57 |
0 |
|
|
339412 |
127261308 |
1 |
OH16C17 |
AB16C17 |
8.59 |
4.42 |
-8.9 |
-0.56 |
0 |
|
|
339413 |
127261309 |
1 |
OC14H22 |
AB14C22 |
-61.47 |
2.93 |
-9.13 |
0.74 |
0 |
|
|
339414 |
127261310 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-12.17 |
6.03 |
-8.57 |
-1.08 |
0 |
|
|
339415 |
127261311 |
1 |
NOC16H17 |
ABC16D17 |
5.22 |
3.05 |
-8.28 |
-0.11 |
0 |
|
|
339416 |
127261312 |
1 |
OC15H24 |
AB15C24 |
-66.64 |
3.22 |
-8.99 |
0.76 |
0 |
|
|
339417 |
127261313 |
1 |
NOC12H17 |
ABC12D17 |
3.46 |
1.07 |
-8.57 |
0.39 |
0 |
|
|
339418 |
127261314 |
1 |
NOC14H17 |
ABC14D17 |
21.82 |
1.36 |
-8.57 |
0.26 |
0 |
|
|
339419 |
127261315 |
1 |
NO2C13H19 |
AB2C13D19 |
-44.58 |
3.12 |
-8.75 |
0.2 |
0 |
|
|
339420 |
127261316 |
1 |
NOC11H15 |
ABC11D15 |
8.5 |
1.16 |
-8.59 |
0.36 |
0 |
|
|
339421 |
127261317 |
1 |
NO2C19H29 |
AB2C19D29 |
-36.19 |
1.9 |
-8.26 |
0.17 |
0 |
|
|
339422 |
127261318 |
1 |
NO2C10H13 |
AB2C10D13 |
-27.72 |
3.46 |
-8.8 |
0.13 |
0 |
|
|
339423 |
127261319 |
1 |
NO3C20H33 |
AB3C20D33 |
-108.8 |
2.4 |
-8.32 |
0.11 |
0 |
|
|
339424 |
127261320 |
1 |
SO3C11H12 |
AB3C11D12 |
-87.72 |
4.8 |
-10.13 |
-1.36 |
0 |
|
|
339425 |
127261321 |
1 |
SO2H14C16 |
AB2C14D16 |
1.59 |
2.97 |
-8.52 |
-0.84 |
0 |
|
|
339426 |
127261322 |
1 |
ON2C20H24 |
AB2C20D24 |
-23.78 |
3.72 |
-8.32 |
0.16 |
0 |
|
|
339427 |
127261323 |
1 |
O3C20H30 |
A3B20C30 |
-135.03 |
7.22 |
-9.11 |
-0.29 |
0 |
|
|
339428 |
127261324 |
1 |
NO3C15H21 |
AB3C15D21 |
-79.38 |
2.41 |
-8.78 |
0.21 |
0 |
|
|
339429 |
127261325 |
1 |
ON2H12C14 |
AB2C12D14 |
41.92 |
3.47 |
-9.5 |
-1.25 |
0 |
|
|
339430 |
127261326 |
1 |
ClOH15C17 |
ABC15D17 |
3.43 |
3.68 |
-9.3 |
-0.82 |
0 |
|
|
339431 |
127261327 |
1 |
OC14H22 |
AB14C22 |
-60.03 |
3.98 |
-9.17 |
0.83 |
0 |
|
|
339432 |
127261328 |
1 |
OSN4C11H12 |
ABC4D11E12 |
70.56 |
2.09 |
-8.56 |
-0.76 |
0 |
|
|
339433 |
127261329 |
1 |
OSN3C11H19 |
ABC3D11E19 |
11.24 |
1.38 |
-8.32 |
-0.22 |
0 |
|
|
339434 |
127261330 |
1 |
OSN3C12H13 |
ABC3D12E13 |
61.31 |
1.74 |
-8.33 |
-0.6 |
0 |
|
|
339435 |
127261331 |
1 |
OSN3C9H15 |
ABC3D9E15 |
22.96 |
2.21 |
-7.99 |
-0.04 |
0 |
|
|
339436 |
127261332 |
1 |
OSN3C13H15 |
ABC3D13E15 |
51.81 |
0.98 |
-8.18 |
-0.53 |
0 |
|
|
339437 |
127261333 |
1 |
N2O2H18C23 |
A2B2C18D23 |
58.37 |
9.78 |
-7.81 |
-1.37 |
0 |
|
|
339438 |
127261334 |
1 |
OSCl2N2H10C12 |
ABC2D2E10F12 |
21.64 |
3.3 |
-8.32 |
-0.96 |
0 |
|
|
339439 |
127261335 |
2 |
OC4H4 |
AB4C4 |
-44.23 |
2.5 |
-9.16 |
-1.14 |
0 |
|
|
339440 |
127261336 |
1 |
OSN4C10H10 |
ABC4D10E10 |
87.3 |
2.39 |
-8.77 |
-0.82 |
0 |
|
|
339441 |
127261337 |
1 |
NSiO2C9H15 |
ABC2D9E15 |
-40.9 |
1.04 |
-8.44 |
0.24 |
0 |
|
|
339442 |
127261338 |
1 |
NOSSiC9H15 |
ABCDE9F15 |
-12.79 |
1.2 |
-8.5 |
0.07 |
0 |
|
|
339443 |
127261339 |
1 |
OC14H22 |
AB14C22 |
-54.76 |
3.57 |
-9.43 |
0.74 |
0 |
|
|
339444 |
127261340 |
1 |
NOSH15C17 |
ABCD15E17 |
24.15 |
3.8 |
-8.47 |
-0.53 |
0 |
|
|
339445 |
127261341 |
1 |
ON3H11C12 |
AB3C11D12 |
81.07 |
2.67 |
-9.05 |
-0.87 |
0 |
|
|
339446 |
127261342 |
1 |
ON2C15H20 |
AB2C15D20 |
21.75 |
1.01 |
-8.64 |
0.24 |
0 |
|
|
339447 |
127261343 |
1 |
OC16H20 |
AB16C20 |
-20.9 |
3.08 |
-9.11 |
-0.49 |
0 |
|
|
339448 |
127261344 |
1 |
NOC14H17 |
ABC14D17 |
-10.6 |
4.58 |
-8.54 |
0.01 |
0 |
|
|
339449 |
127261345 |
1 |
OSN3H13C15 |
ABC3D13E15 |
82.73 |
3.16 |
-8.37 |
-0.4 |
0 |
|
|
339450 |
127261346 |
1 |
ON3C11H11 |
AB3C11D11 |
68.78 |
4.15 |
-8.96 |
-0.53 |
0 |
|
|
339451 |
127261347 |
2 |
OH9C10 |
AB9C10 |
-12.74 |
3.0 |
-8.83 |
-0.95 |
0 |
|
|
339452 |
127261348 |
1 |
ON2C14H20 |
AB2C14D20 |
13.43 |
2.94 |
-8.0 |
0.27 |
0 |
|
|
339453 |
127261349 |
1 |
ON3H11C12 |
AB3C11D12 |
70.84 |
2.24 |
-9.42 |
-0.73 |
0 |
|
|
339454 |
127261350 |
1 |
ON3H11C12 |
AB3C11D12 |
69.37 |
2.15 |
-9.43 |
-0.74 |
0 |
|
|
339455 |
127261388 |
1 |
SN2O3C18H20 |
AB2C3D18E20 |
-68.0 |
5.12 |
-9.56 |
-0.86 |
0 |
|
|
339456 |
127261389 |
1 |
SN2O3C18H20 |
AB2C3D18E20 |
-67.66 |
6.48 |
-9.5 |
-0.94 |
0 |
|
|
339457 |
127261390 |
2 |
ON3H5C9 |
AB3C5D9 |
196.79 |
6.62 |
-9.31 |
-2.29 |
0 |
|
|
339458 |
127261391 |
1 |
SN4C25H26 |
AB4C25D26 |
148.39 |
11.56 |
-8.16 |
-2.19 |
0 |
|
|
339459 |
127261392 |
1 |
N3H9C19 |
A3B9C19 |
178.51 |
5.94 |
-8.92 |
-2.21 |
0 |
|
|
339460 |
127261393 |
1 |
ON2C11H16 |
AB2C11D16 |
-16.69 |
5.75 |
-8.49 |
-0.11 |
0 |
|
|
339461 |
127261394 |
1 |
O2C13H20 |
A2B13C20 |
-96.79 |
1.83 |
-9.19 |
0.36 |
0 |
|
|
339462 |
127261395 |
2 |
O2C8H9 |
A2B8C9 |
-121.42 |
3.15 |
-8.17 |
-0.17 |
0 |
|
|
339463 |
127261396 |
1 |
NOC13H17 |
ABC13D17 |
-17.51 |
2.19 |
-8.8 |
0.22 |
0 |
|
|
339464 |
127261397 |
2 |
OSN2C12H16 |
ABC2D12E16 |
-36.82 |
10.57 |
-9.03 |
-1.46 |
0 |
|
|
339465 |
127261398 |
1 |
N2F3O3H21C26 |
A2B3C3D21E26 |
-203.63 |
4.13 |
-8.67 |
-0.94 |
0 |
|
|
339466 |
127261399 |
1 |
ClN2O7C19H27 |
AB2C7D19E27 |
-153.71 |
12.18 |
-10.41 |
-2.59 |
0 |
|
|
339467 |
127261400 |
1 |
Cl2N3C18H23 |
A2B3C18D23 |
3.62 |
5.95 |
-8.14 |
-0.21 |
0 |
|
|
339468 |
127261401 |
1 |
NO7C18H21 |
AB7C18D21 |
-233.73 |
4.46 |
-9.81 |
-0.16 |
0 |
|
|
339469 |
127261402 |
2 |
NO2C7H8 |
AB2C7D8 |
-133.11 |
4.58 |
-9.1 |
-0.76 |
0 |
|
|
339470 |
127261403 |
1 |
S2N3O4C17H19 |
A2B3C4D17E19 |
-102.26 |
4.87 |
-8.93 |
-1.38 |
0 |
|
|
339471 |
127261404 |
1 |
O2N5C15H15 |
A2B5C15D15 |
17.17 |
2.95 |
-8.75 |
-1.35 |
0 |
|
|
339472 |
127261405 |
1 |
N3O6H23C24 |
A3B6C23D24 |
-157.63 |
3.05 |
-9.29 |
-1.01 |
0 |
|
|
339473 |
127261406 |
1 |
N3O5H21C24 |
A3B5C21D24 |
-102.35 |
7.69 |
-9.3 |
-1.12 |
0 |
|
|
339474 |
127261407 |
1 |
NPO5C16H18 |
ABC5D16E18 |
-157.45 |
6.93 |
-9.52 |
-1.24 |
0 |
|
|
339475 |
127261408 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-4.1 |
4.89 |
-8.4 |
-1.0 |
0 |
|
|
339476 |
127261409 |
1 |
ClON2C25H27 |
ABC2D25E27 |
22.6 |
5.75 |
-8.71 |
-0.78 |
0 |
|
|
339477 |
127261410 |
1 |
BrN2O2H11C13 |
AB2C2D11E13 |
-27.55 |
2.42 |
-9.82 |
-1.53 |
0 |
|
|
339478 |
127261411 |
1 |
NO2C11H17 |
AB2C11D17 |
-75.36 |
6.32 |
-8.52 |
0.33 |
0 |