List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
23643 |
605305 |
2 |
ON2H3C4 |
AB2C3D4 |
94.1 |
4.84 |
-10.76 |
-2.05 |
0 |
|
|
23644 |
605307 |
2 |
C7H11 |
A7B11 |
-46.99 |
0.08 |
-9.93 |
3.9 |
0 |
|
|
23645 |
605308 |
1 |
NO2Cl3C12H12 |
AB2C3D12E12 |
-100.35 |
3.8 |
-9.4 |
-0.56 |
0 |
|
|
23646 |
605309 |
1 |
NCl2O2C18H19 |
AB2C2D18E19 |
-62.09 |
5.02 |
-8.89 |
-0.37 |
0 |
|
|
23647 |
605311 |
1 |
FeO4H10C12 |
AB4C10D12 |
20.82 |
3.68 |
-7.53 |
0.77 |
-4 |
|
|
23648 |
605312 |
1 |
OC9H10 |
AB9C10 |
-12.99 |
3.1 |
-10.04 |
0.66 |
-4 |
|
|
23649 |
605313 |
1 |
NO2C12H17 |
AB2C12D17 |
-51.62 |
2.67 |
-8.75 |
-0.43 |
0 |
|
|
23650 |
605314 |
1 |
FN2O2H15C18 |
AB2C2D15E18 |
-52.15 |
4.07 |
-8.98 |
-1.45 |
0 |
|
|
23651 |
605316 |
2 |
SH3C5 |
AB3C5 |
59.38 |
1.52 |
-8.4 |
-0.64 |
0 |
|
|
23652 |
605318 |
1 |
S3C7H10 |
A3B7C10 |
25.48 |
0.88 |
-8.54 |
-0.63 |
0 |
|
|
23653 |
605322 |
2 |
OC6H7 |
AB6C7 |
-76.43 |
1.83 |
-9.09 |
0.45 |
0 |
|
|
23654 |
605324 |
1 |
ON4C9H10 |
AB4C9D10 |
67.86 |
4.5 |
-9.37 |
-0.75 |
0 |
|
|
23655 |
605325 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-41.61 |
3.72 |
-10.09 |
-1.04 |
0 |
|
|
23656 |
605328 |
2 |
C7H10 |
A7B10 |
35.06 |
0.08 |
-7.7 |
0.71 |
-4 |
|
|
23657 |
605329 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-54.87 |
3.76 |
-8.73 |
-0.5 |
0 |
|
|
23658 |
605330 |
1 |
OCl2C4N4 |
AB2C4D4 |
111.88 |
2.65 |
-11.0 |
-2.64 |
0 |
|
|
23659 |
605331 |
2 |
ClO3C6H6 |
AB3C6D6 |
-225.37 |
2.98 |
-9.38 |
-1.16 |
0 |
|
|
23660 |
605332 |
1 |
N2O3H6C9 |
A2B3C6D9 |
7.06 |
4.1 |
-9.58 |
-1.76 |
0 |
|
|
23661 |
605333 |
1 |
ON2S2C6H10 |
AB2C2D6E10 |
-19.62 |
1.79 |
-8.6 |
-0.64 |
0 |
|
|
23662 |
605348 |
1 |
NO2C12H17 |
AB2C12D17 |
-14.09 |
5.01 |
-10.14 |
-1.14 |
0 |
|
|
23663 |
605349 |
2 |
O2H3C5 |
A2B3C5 |
-86.74 |
1.73 |
-9.87 |
-1.83 |
0 |
|
|
23664 |
605350 |
1 |
O2N3F6H7C9 |
A2B3C6D7E9 |
-350.75 |
4.82 |
-10.37 |
-1.68 |
0 |
|
|
23665 |
605351 |
2 |
OC6H7 |
AB6C7 |
-62.17 |
3.81 |
-8.7 |
0.23 |
0 |
|
|
23666 |
605353 |
1 |
OCl3N3H12C14 |
AB3C3D12E14 |
-24.33 |
4.35 |
-9.26 |
-0.98 |
0 |
|
|
23667 |
605354 |
2 |
OSN3C5H8 |
ABC3D5E8 |
13.57 |
7.47 |
-9.45 |
-0.97 |
0 |