List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
80315 |
49834023 |
1 |
F2N5C13H17 |
A2B5C13D17 |
-2.44 |
4.37 |
-8.99 |
-0.73 |
0 |
|
|
80316 |
49834028 |
2 |
ClNO2C16H16 |
ABC2D16E16 |
-121.82 |
3.83 |
-8.81 |
-0.54 |
0 |
|
|
80317 |
49834031 |
1 |
FO4N5C22H24 |
AB4C5D22E24 |
-115.45 |
2.82 |
-9.7 |
-1.06 |
0 |
|
|
80318 |
49834032 |
1 |
FO4N5C22H24 |
AB4C5D22E24 |
-106.62 |
1.61 |
-9.49 |
-0.95 |
0 |
|
|
80319 |
49834033 |
2 |
ClF2O2N4H15C18 |
AB2C2D4E15F18 |
-209.13 |
7.83 |
-9.2 |
-1.08 |
0 |
|
|
80320 |
49834037 |
1 |
FCl2O4N7H34C42 |
AB2C4D7E34F42 |
10.45 |
3.68 |
-9.32 |
-1.33 |
0 |
|
|
80321 |
49834038 |
1 |
Cl2F3O5N7H30C38 |
A2B3C5D7E30F38 |
-197.08 |
5.77 |
-9.26 |
-0.96 |
0 |
|
|
80322 |
49834041 |
1 |
SO2N6C29H34 |
AB2C6D29E34 |
29.26 |
4.72 |
-8.65 |
-0.98 |
0 |
|
|
80323 |
49834043 |
1 |
OSN7C26H31 |
ABC7D26E31 |
88.72 |
2.94 |
-8.48 |
-1.01 |
0 |
|
|
80324 |
49834047 |
2 |
NOC9H9 |
ABC9D9 |
-24.33 |
6.01 |
-8.42 |
-0.61 |
0 |
|
|
80325 |
49834049 |
1 |
N2O2C23H26 |
A2B2C23D26 |
-36.89 |
4.16 |
-8.46 |
-0.66 |
0 |
|
|
80326 |
49834051 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-1.26 |
7.12 |
-8.48 |
-0.44 |
2 |
|
|
80327 |
49834055 |
1 |
CaO3C11H14 |
AB3C11D14 |
-82.38 |
1.36 |
-5.04 |
-1.43 |
0 |
|
|
80328 |
49834057 |
1 |
ClPN2F4O5H14C19 |
ABC2D4E5F14G19 |
-419.28 |
7.58 |
-9.23 |
-1.24 |
0 |
|
|
80329 |
49834060 |
1 |
ON4H20C21 |
AB4C20D21 |
41.78 |
6.84 |
-8.93 |
-0.44 |
0 |
|
|
80330 |
49834062 |
1 |
ON4C22H22 |
AB4C22D22 |
41.97 |
3.95 |
-8.43 |
-0.25 |
0 |
|
|
80331 |
49834064 |
1 |
ON5C18H23 |
AB5C18D23 |
8.96 |
4.97 |
-8.63 |
-0.67 |
0 |
|
|
80332 |
49834065 |
1 |
ON4C17H20 |
AB4C17D20 |
0.53 |
4.6 |
-8.78 |
-0.57 |
0 |
|
|
80333 |
49834069 |
1 |
FN2O2C24H27 |
AB2C2D24E27 |
-90.88 |
8.12 |
-8.37 |
-0.73 |
0 |
|
|
80334 |
49834071 |
1 |
ClN2O2H17C18 |
AB2C2D17E18 |
-35.6 |
5.76 |
-8.61 |
-0.95 |
0 |
|
|
80335 |
49834076 |
1 |
F3O5N6C45H49 |
A3B5C6D45E49 |
-300.49 |
16.89 |
-8.09 |
-2.21 |
0 |
|
|
80336 |
49834083 |
1 |
O3F5N5H16C21 |
A3B5C5D16E21 |
-239.66 |
4.12 |
-9.45 |
-1.41 |
0 |
|
|
80337 |
49834084 |
1 |
SO2F3N6H13C18 |
AB2C3D6E13F18 |
-69.64 |
5.36 |
-9.34 |
-1.37 |
0 |
|
|
80338 |
49834087 |
2 |
N3O4C16H24 |
A3B4C16D24 |
-374.84 |
3.21 |
-9.34 |
0.11 |
0 |
|
|
80339 |
49834088 |
1 |
O7N8C34H48 |
A7B8C34D48 |
-270.62 |
13.94 |
-8.96 |
-0.08 |
0 |
|
|
80340 |
49834089 |
1 |
N7O7C39H51 |
A7B7C39D51 |
-285.32 |
14.72 |
-8.64 |
-0.17 |
0 |
|
|
80341 |
49834090 |
2 |
SO4N6C18H35 |
AB4C6D18E35 |
-398.15 |
8.77 |
-9.21 |
-0.42 |
0 |
|
|
80342 |
49834091 |
2 |
SO4N8C18H35 |
AB4C8D18E35 |
-380.91 |
18.76 |
-9.11 |
0.07 |
0 |
|
|
80343 |
49834092 |
1 |
SO3N4H20C22 |
AB3C4D20E22 |
10.79 |
3.68 |
-9.11 |
-1.06 |
0 |
|
|
80344 |
49834095 |
1 |
SN3O3C25H27 |
AB3C3D25E27 |
-52.04 |
4.96 |
-8.51 |
-0.51 |
0 |
|
|
80345 |
49834097 |
1 |
BSN4O6H13C14 |
ABC4D6E13F14 |
-207.11 |
12.85 |
-9.41 |
-1.29 |
0 |
|
|
80347 |
49834103 |
1 |
S2N6O9C39H48 |
A2B6C9D39E48 |
-294.1 |
10.51 |
-9.06 |
-0.91 |
0 |
|
|
80348 |
49834105 |
1 |
SN6O10C38H46 |
AB6C10D38E46 |
-323.57 |
8.31 |
-9.09 |
-1.24 |
0 |
|
|
80349 |
49834106 |
1 |
N7O13C26H53 |
A7B13C26D53 |
-609.94 |
9.37 |
-8.96 |
0.15 |
1 |
|
|
80350 |
49834115 |
1 |
ClN3O5C31H35 |
AB3C5D31E35 |
-139.55 |
6.26 |
0.0 |
0.0 |
0 |
|
|
80351 |
49834120 |
1 |
ClSN4O11C41H51 |
ABC4D11E41F51 |
-457.21 |
6.4 |
-9.01 |
-0.72 |
0 |
|
|
80352 |
49834122 |
1 |
ClSN4O11C31H37 |
ABC4D11E31F37 |
-398.98 |
10.7 |
-9.68 |
-1.38 |
0 |
|
|
80353 |
49834126 |
3 |
NC4H5 |
AB4C5 |
55.1 |
4.69 |
-9.16 |
-0.27 |
0 |
|
|
80354 |
49834127 |
1 |
ClN3C9H12 |
AB3C9D12 |
14.67 |
2.13 |
-8.9 |
-0.61 |
0 |
|
|
80355 |
49834140 |
1 |
O2F4N4H26C29 |
A2B4C4D26E29 |
-201.35 |
1.05 |
-8.95 |
-1.05 |
0 |
|
|
80356 |
49834146 |
1 |
FNO6H34C35 |
ABC6D34E35 |
-213.53 |
7.6 |
-9.69 |
-1.01 |
0 |
|
|
80357 |
49834148 |
1 |
FNO6C36H36 |
ABC6D36E36 |
-218.56 |
3.94 |
-9.65 |
-0.85 |
0 |
|
|
80358 |
49834149 |
1 |
BrO2N3C25H34 |
AB2C3D25E34 |
-33.31 |
4.3 |
-8.68 |
-0.34 |
0 |
|
|
80359 |
49834152 |
1 |
BrN3O4C26H34 |
AB3C4D26E34 |
-142.02 |
8.16 |
-8.87 |
-0.22 |
0 |
|
|
80360 |
49834155 |
1 |
BrClN2O2H20C25 |
ABC2D2E20F25 |
-9.68 |
4.51 |
-8.81 |
-0.51 |
0 |
|
|
80361 |
49834167 |
1 |
SO2N8H30C33 |
AB2C8D30E33 |
120.28 |
6.83 |
-7.86 |
-0.83 |
0 |
|
|
80362 |
49834169 |
1 |
ClSO3N4H19C20 |
ABC3D4E19F20 |
-38.22 |
10.07 |
-9.0 |
-0.52 |
0 |
|
|
80363 |
49834170 |
1 |
ClSN3O3H20C22 |
ABC3D3E20F22 |
-38.76 |
2.7 |
-9.27 |
-1.27 |
0 |
|
|
80364 |
49834171 |
1 |
ClSO3N4C21H21 |
ABC3D4E21F21 |
-37.76 |
10.03 |
-8.75 |
-0.31 |
0 |
|
|
80365 |
49834175 |
1 |
O3N6C28H30 |
A3B6C28D30 |
-18.23 |
3.93 |
-8.36 |
-0.92 |
0 |