List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
45288 |
10510605 |
1 |
O38C51H76 |
A38B51C76 |
-1648.33 |
2.94 |
-10.32 |
-1.26 |
0 |
|
|
45289 |
10510716 |
2 |
O4C50H93 |
A4B50C93 |
-647.65 |
6.22 |
-9.37 |
0.28 |
0 |
|
|
45290 |
10510731 |
1 |
SN19O21C69H117 |
AB19C21D69E117 |
-981.65 |
17.27 |
-8.26 |
-0.74 |
0 |
|
|
45291 |
10510732 |
1 |
S5O37C62H84 |
A5B37C62D84 |
-1710.31 |
5.84 |
-9.22 |
-0.39 |
0 |
|
|
45292 |
10510736 |
1 |
O34C79H124 |
A34B79C124 |
-1609.73 |
8.49 |
-9.52 |
-0.17 |
0 |
|
|
45293 |
10510741 |
1 |
N15O24C75H121 |
A15B24C75D121 |
-1175.63 |
4.67 |
-9.12 |
-0.6 |
0 |
|
|
45295 |
10510798 |
1 |
Br2C195H358 |
A2B195C358 |
-564.93 |
3.05 |
-9.37 |
-0.05 |
0 |
|
|
45296 |
10510813 |
1 |
N2C5H8 |
A2B5C8 |
54.42 |
4.21 |
-8.47 |
0.49 |
0 |
|
|
45297 |
10510814 |
1 |
SH4C5 |
AB4C5 |
99.47 |
2.08 |
-9.0 |
-1.7 |
0 |
|
|
45298 |
10510864 |
1 |
O2C7H10 |
A2B7C10 |
-83.67 |
1.93 |
-10.14 |
0.02 |
0 |
|
|
45299 |
10510867 |
1 |
ClF2C4H5 |
AB2C4D5 |
-103.26 |
2.24 |
-10.16 |
-0.1 |
0 |
|
|
45300 |
10510877 |
1 |
NOC7H15 |
ABC7D15 |
-43.22 |
2.4 |
-9.69 |
2.21 |
0 |
|
|
45301 |
10510894 |
1 |
ON2H6C7 |
AB2C6D7 |
-11.82 |
3.35 |
-8.86 |
-0.33 |
0 |
|
|
45303 |
10510915 |
1 |
NC9H15 |
AB9C15 |
31.98 |
1.71 |
-9.17 |
0.97 |
0 |
|
|
45304 |
10510921 |
1 |
OC9H14 |
AB9C14 |
-26.15 |
3.87 |
-9.92 |
0.46 |
0 |
|
|
45305 |
10510922 |
2 |
NC4H7 |
AB4C7 |
9.04 |
3.18 |
-9.18 |
0.88 |
0 |
|
|
45306 |
10510936 |
1 |
O3C7H8 |
A3B7C8 |
-114.42 |
5.35 |
-10.67 |
0.21 |
0 |
|
|
45307 |
10510946 |
1 |
NO2C7H11 |
AB2C7D11 |
-85.95 |
6.38 |
-10.23 |
0.48 |
0 |
|
|
45308 |
10510948 |
1 |
NOC8H15 |
ABC8D15 |
-59.64 |
4.78 |
-9.25 |
1.2 |
0 |
|
|
45309 |
10510980 |
1 |
O3C7H12 |
A3B7C12 |
-153.41 |
5.18 |
-10.53 |
0.22 |
0 |
|
|
45310 |
10510988 |
2 |
OC4H9 |
AB4C9 |
-117.91 |
0.45 |
-9.59 |
2.25 |
0 |
|
|
45311 |
10510998 |
1 |
FNH8C9 |
ABC8D9 |
32.27 |
1.55 |
-9.8 |
-0.17 |
0 |
|
|
45314 |
10511037 |
1 |
OC10H16 |
AB10C16 |
-32.81 |
3.16 |
-9.77 |
-0.26 |
0 |
|
|
45315 |
10511063 |
1 |
O2C9H14 |
A2B9C14 |
-95.18 |
2.58 |
-10.01 |
-0.04 |
0 |
|
|
45316 |
10511076 |
1 |
O2C9H14 |
A2B9C14 |
-71.73 |
3.35 |
-9.84 |
1.81 |
0 |
|
|
45317 |
10511092 |
1 |
NOC9H17 |
ABC9D17 |
-53.44 |
1.31 |
-9.61 |
1.32 |
0 |
|
|
45318 |
10511120 |
1 |
ClN2C7H9 |
AB2C7D9 |
6.92 |
4.18 |
-8.62 |
-0.25 |
0 |
|
|
45319 |
10511136 |
1 |
O3C8H14 |
A3B8C14 |
-159.02 |
3.13 |
-10.47 |
0.63 |
0 |
|
|
45320 |
10511149 |
1 |
NC11H13 |
AB11C13 |
53.03 |
4.96 |
-9.3 |
-0.44 |
0 |
|
|
45321 |
10511150 |
1 |
N2O4C5H8 |
A2B4C5D8 |
-144.06 |
0.79 |
-10.23 |
-0.88 |
0 |
|
|
45322 |
10511158 |
1 |
O3C8H16 |
A3B8C16 |
-134.22 |
2.16 |
-9.84 |
0.97 |
0 |
|
|
45323 |
10511183 |
1 |
O5C6H10 |
A5B6C10 |
-202.22 |
3.22 |
-10.17 |
-1.12 |
0 |
|
|
45324 |
10511240 |
1 |
NOC10H15 |
ABC10D15 |
-38.85 |
1.63 |
-9.41 |
0.21 |
0 |
|
|
45325 |
10511242 |
1 |
NC11H19 |
AB11C19 |
-8.92 |
1.78 |
-9.18 |
1.3 |
0 |
|
|
45326 |
10511243 |
1 |
F2O3C6H8 |
A2B3C6D8 |
-201.75 |
3.03 |
-9.73 |
-0.56 |
0 |
|
|
45327 |
10511282 |
1 |
O2N3C7H9 |
A2B3C7D9 |
-48.76 |
5.78 |
-9.68 |
-0.64 |
0 |
|
|
45328 |
10511322 |
2 |
NSH2C3 |
ABC2D3 |
108.67 |
3.16 |
-9.27 |
-1.16 |
0 |
|
|
45329 |
10511329 |
1 |
OC11H20 |
AB11C20 |
-39.18 |
2.65 |
-9.77 |
1.06 |
0 |
|
|
45330 |
10511330 |
1 |
OC11H20 |
AB11C20 |
-55.12 |
2.55 |
-9.7 |
0.89 |
0 |
|
|
45331 |
10511344 |
1 |
N2O3C7H10 |
A2B3C7D10 |
-88.45 |
1.98 |
-9.13 |
-0.15 |
0 |
|
|
45332 |
10511351 |
1 |
O3C9H14 |
A3B9C14 |
-136.54 |
2.91 |
-9.97 |
0.55 |
0 |
|
|
45333 |
10511361 |
2 |
OC5H9 |
AB5C9 |
-108.57 |
1.17 |
-9.89 |
0.88 |
0 |
|
|
45334 |
10511418 |
2 |
O2C4H7 |
A2B4C7 |
-184.48 |
1.43 |
-10.15 |
0.4 |
0 |
|
|
45335 |
10511447 |
1 |
ClN2O2C6H7 |
AB2C2D6E7 |
-47.23 |
5.8 |
-9.75 |
-0.34 |
0 |
|
|
45336 |
10511475 |
1 |
N2O2H8C9 |
A2B2C8D9 |
-25.1 |
3.38 |
-8.99 |
-1.25 |
0 |
|
|
45337 |
10511481 |
1 |
O2C11H12 |
A2B11C12 |
-40.93 |
0.33 |
-9.71 |
-1.77 |
0 |
|
|
45338 |
10511498 |
1 |
ClON4C5H9 |
ABC4D5E9 |
-43.44 |
5.01 |
-9.1 |
-0.51 |
0 |
|
|
45339 |
10511578 |
1 |
SN4C7H8 |
AB4C7D8 |
90.3 |
3.82 |
-9.42 |
-1.86 |
0 |
|
|
45340 |
10511582 |
1 |
O2C11H16 |
A2B11C16 |
-60.74 |
2.3 |
-9.56 |
0.7 |
0 |
|
|
45341 |
10511616 |
1 |
NOC11H19 |
ABC11D19 |
-83.64 |
5.13 |
-9.68 |
1.4 |
0 |