List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
52460 |
12015325 |
1 |
ON3H17C20 |
AB3C17D20 |
107.81 |
3.09 |
-9.27 |
-1.21 |
0 |
|
|
52461 |
12015326 |
1 |
O2N3H15C19 |
A2B3C15D19 |
119.39 |
15.0 |
-7.05 |
-2.5 |
0 |
|
|
52462 |
12015327 |
2 |
ON2H6C7 |
AB2C6D7 |
79.28 |
1.12 |
-9.56 |
-1.78 |
0 |
|
|
52463 |
12015328 |
1 |
O2N3H15C19 |
A2B3C15D19 |
74.11 |
3.92 |
-9.86 |
-0.52 |
0 |
|
|
52468 |
12015335 |
1 |
SN2C7H14 |
AB2C7D14 |
20.83 |
4.66 |
-9.06 |
-0.35 |
0 |
|
|
52469 |
12015336 |
1 |
SN2O2C12H14 |
AB2C2D12E14 |
-34.91 |
4.91 |
-9.58 |
-0.55 |
0 |
|
|
52470 |
12015337 |
1 |
NSO5C17H21 |
ABC5D17E21 |
-162.77 |
9.04 |
-9.15 |
-0.34 |
0 |
|
|
52471 |
12015338 |
1 |
NSC8H15 |
ABC8D15 |
-0.15 |
4.12 |
-9.35 |
-0.26 |
0 |
|
|
52472 |
12015344 |
1 |
NO4C13H23 |
AB4C13D23 |
-220.02 |
2.92 |
-9.61 |
0.3 |
0 |
|
|
52473 |
12015346 |
1 |
NO2C14H23 |
AB2C14D23 |
-130.2 |
3.61 |
-10.12 |
0.21 |
0 |
|
|
52474 |
12015349 |
1 |
FeOH16C18 |
ABC16D18 |
47.54 |
3.24 |
-8.86 |
-0.99 |
0 |
|
|
52475 |
12015351 |
1 |
FeO2C18H18 |
AB2C18D18 |
50.18 |
3.4 |
-8.4 |
-0.56 |
0 |
|
|
52476 |
12015353 |
1 |
FeNOC18H19 |
ABCD18E19 |
44.49 |
5.12 |
-8.59 |
-0.33 |
0 |
|
|
52477 |
12015354 |
1 |
NOC13H15 |
ABC13D15 |
11.65 |
2.16 |
-9.35 |
-0.03 |
0 |
|
|
52478 |
12015355 |
1 |
FeNO2H17C19 |
ABC2D17E19 |
37.52 |
16.0 |
-6.65 |
-1.98 |
0 |
|
|
52479 |
12015356 |
1 |
NO2H13C14 |
AB2C13D14 |
-21.19 |
5.54 |
-9.84 |
-0.23 |
0 |
|
|
52480 |
12015357 |
1 |
FeNaSN2O2H17C18 |
ABCD2E2F17G18 |
50.31 |
10.49 |
-6.67 |
-0.93 |
0 |
|
|
52481 |
12015358 |
1 |
SN2O2C13H14 |
AB2C2D13E14 |
4.14 |
5.54 |
-9.37 |
-0.49 |
0 |
|
|
52482 |
12015359 |
1 |
SO2C19H20 |
AB2C19D20 |
-20.86 |
1.21 |
-9.3 |
-0.41 |
0 |
|
|
52483 |
12015361 |
1 |
NO2C21H21 |
AB2C21D21 |
-32.88 |
2.99 |
-8.47 |
-0.39 |
0 |
|
|
52484 |
12015362 |
1 |
NO3C22H23 |
AB3C22D23 |
-71.07 |
3.64 |
-8.72 |
-0.39 |
0 |
|
|
52485 |
12015363 |
1 |
O2F3H5C7 |
A2B3C5D7 |
-158.5 |
8.6 |
-9.85 |
-0.85 |
0 |
|
|
52486 |
12015364 |
2 |
OC4H5 |
AB4C5 |
-16.97 |
6.39 |
-9.33 |
-0.06 |
0 |
|
|
52487 |
12015365 |
2 |
OC5H7 |
AB5C7 |
-27.99 |
6.85 |
-9.3 |
-0.19 |
0 |
|
|
52488 |
12015366 |
1 |
N2C7H10 |
A2B7C10 |
14.25 |
3.49 |
-9.05 |
0.18 |
0 |
|
|
52489 |
12015367 |
2 |
NOC6H6 |
ABC6D6 |
-28.92 |
2.75 |
-9.72 |
-0.6 |
0 |
|
|
52490 |
12015368 |
1 |
N2O2H12C13 |
A2B2C12D13 |
-25.88 |
5.18 |
-9.67 |
-0.51 |
0 |
|
|
52491 |
12015369 |
9 |
NOC3H3 |
ABC3D3 |
-259.02 |
8.6 |
-9.77 |
-1.88 |
0 |
|
|
52492 |
12015371 |
6 |
NH4C5 |
AB4C5 |
182.21 |
5.16 |
-9.14 |
-0.74 |
0 |
|
|
52493 |
12015372 |
1 |
SN2O6H12C19 |
AB2C6D12E19 |
-130.82 |
7.93 |
-9.82 |
-1.53 |
0 |
|
|
52494 |
12015373 |
1 |
SN2O5H14C20 |
AB2C5D14E20 |
-98.66 |
5.82 |
-9.81 |
-1.58 |
0 |
|
|
52495 |
12015374 |
1 |
SN3O5H13C19 |
AB3C5D13E19 |
-99.69 |
5.88 |
-9.81 |
-1.57 |
0 |
|
|
52496 |
12015376 |
1 |
SN2O4H16C21 |
AB2C4D16E21 |
-62.41 |
7.41 |
-9.66 |
-1.54 |
0 |
|
|
52497 |
12015379 |
1 |
N2O2H12C17 |
A2B2C12D17 |
34.5 |
1.82 |
-8.77 |
-1.37 |
0 |
|
|
52498 |
12015380 |
1 |
S2O3N4C13H16 |
A2B3C4D13E16 |
-80.64 |
2.73 |
-8.8 |
-1.24 |
0 |
|
|
52499 |
12015381 |
1 |
SO3N6C12H16 |
AB3C6D12E16 |
-61.73 |
2.73 |
-8.83 |
-1.12 |
0 |
|
|
52500 |
12015382 |
1 |
SO4N6C16H18 |
AB4C6D16E18 |
-56.4 |
4.85 |
-8.7 |
-1.34 |
0 |
|
|
52501 |
12015384 |
1 |
SO3N5H17C19 |
AB3C5D17E19 |
-16.17 |
4.93 |
-8.71 |
-1.39 |
0 |
|
|
52502 |
12015385 |
1 |
ClSO3N5H16C19 |
ABC3D5E16F19 |
-27.9 |
3.13 |
-8.79 |
-1.54 |
0 |
|
|
52503 |
12015386 |
1 |
ClSO3N5H16C19 |
ABC3D5E16F19 |
-26.52 |
5.29 |
-8.7 |
-1.37 |
0 |
|
|
52504 |
12015388 |
1 |
SO3N5H19C20 |
AB3C5D19E20 |
-29.4 |
5.93 |
-8.6 |
-1.24 |
0 |
|
|
52505 |
12015389 |
1 |
S2O3N4H16C19 |
A2B3C4D16E19 |
-23.86 |
3.89 |
-8.9 |
-1.71 |
0 |
|
|
52506 |
12015390 |
2 |
SN2O2C7H10 |
AB2C2D7E10 |
-139.96 |
1.72 |
-9.07 |
-1.51 |
0 |
|
|
52507 |
12015391 |
1 |
KS2O3N4C12H13 |
AB2C3D4E12F13 |
-130.02 |
7.5 |
-8.02 |
-0.69 |
0 |
|
|
52508 |
12015392 |
1 |
ClS2N3O4C20H22 |
AB2C3D4E20F22 |
-137.41 |
3.39 |
-8.9 |
-1.44 |
0 |
|
|
52509 |
12015393 |
1 |
S2N3O5C21H25 |
A2B3C5D21E25 |
-179.91 |
10.7 |
-8.5 |
-1.01 |
0 |
|
|
52510 |
12015394 |
1 |
S2N3O4C21H25 |
A2B3C4D21E25 |
-134.91 |
5.8 |
-8.78 |
-0.95 |
0 |
|
|
52511 |
12015395 |
1 |
SO3N5C18H19 |
AB3C5D18E19 |
-52.51 |
4.58 |
-8.63 |
-1.11 |
0 |
|
|
52512 |
12015396 |
1 |
ClSO3N5C18H18 |
ABC3D5E18F18 |
-62.15 |
4.37 |
-8.71 |
-1.23 |
0 |
|
|
52513 |
12015397 |
1 |
ClSO3N5C18H18 |
ABC3D5E18F18 |
-60.93 |
3.69 |
-8.69 |
-1.16 |
0 |