List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
209495 |
80680163 |
1 |
BrNOC14H20 |
ABCD14E20 |
-26.93 |
3.54 |
-9.2 |
-0.22 |
0 |
|
|
209496 |
80680173 |
1 |
NOBr2C13H17 |
ABC2D13E17 |
-23.79 |
2.63 |
-8.97 |
-0.16 |
0 |
|
|
209497 |
80680174 |
1 |
BrNC16H22 |
ABC16D22 |
-5.49 |
3.43 |
-8.8 |
-0.04 |
0 |
|
|
209498 |
80680275 |
1 |
FNBr2C16H16 |
ABC2D16E16 |
3.18 |
3.18 |
-9.42 |
-0.53 |
0 |
|
|
209499 |
80680276 |
1 |
NBr2C16H17 |
AB2C16D17 |
48.21 |
3.24 |
-9.33 |
-0.26 |
0 |
|
|
209500 |
80680332 |
1 |
BrNSO2C9H18 |
ABCD2E9F18 |
-106.98 |
5.4 |
-9.07 |
-0.21 |
0 |
|
|
209501 |
80680676 |
2 |
ON2C7H9 |
AB2C7D9 |
-16.89 |
5.82 |
-9.2 |
-0.54 |
0 |
|
|
209502 |
80680935 |
1 |
N4C13H24 |
A4B13C24 |
16.3 |
3.23 |
-8.72 |
0.37 |
0 |
|
|
209503 |
80681000 |
1 |
ON5C14H21 |
AB5C14D21 |
15.37 |
3.88 |
-8.01 |
0.32 |
0 |
|
|
209504 |
80681001 |
1 |
SO2N4C13H18 |
AB2C4D13E18 |
-24.97 |
6.72 |
-8.58 |
-0.17 |
0 |
|
|
209505 |
80682027 |
1 |
N4C9H16 |
A4B9C16 |
54.02 |
4.51 |
-9.06 |
0.71 |
0 |
|
|
209506 |
80682097 |
1 |
N4C15H20 |
A4B15C20 |
60.3 |
2.91 |
-8.38 |
0.39 |
0 |
|
|
209507 |
80682195 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-56.19 |
4.83 |
-9.06 |
0.72 |
0 |
|
|
209508 |
80682196 |
1 |
ClN3C16H20 |
AB3C16D20 |
51.82 |
2.49 |
-9.08 |
-0.03 |
0 |
|
|
209509 |
80682197 |
1 |
ON4C12H20 |
AB4C12D20 |
-20.13 |
5.99 |
-9.2 |
0.52 |
0 |
|
|
209510 |
80682198 |
1 |
ON4C11H18 |
AB4C11D18 |
-14.88 |
1.97 |
-9.11 |
0.84 |
0 |
|
|
209511 |
80682199 |
1 |
ON7C9H13 |
AB7C9D13 |
48.84 |
4.12 |
-9.32 |
-0.6 |
0 |
|
|
209512 |
80682200 |
1 |
ON4C12H20 |
AB4C12D20 |
-22.2 |
4.93 |
-8.85 |
0.52 |
0 |
|
|
209513 |
80682201 |
1 |
ON4C14H24 |
AB4C14D24 |
-24.66 |
3.14 |
-8.93 |
0.59 |
0 |
|
|
209514 |
80682204 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-21.72 |
7.85 |
-9.38 |
-0.69 |
0 |
|
|
209515 |
80682263 |
1 |
ON5C11H19 |
AB5C11D19 |
-10.9 |
4.62 |
-9.29 |
0.24 |
0 |
|
|
209516 |
80682537 |
1 |
SN3C12H17 |
AB3C12D17 |
59.51 |
2.72 |
-8.92 |
0.02 |
0 |
|
|
209517 |
80682538 |
1 |
ON4C13H22 |
AB4C13D22 |
-27.32 |
2.46 |
-8.89 |
0.77 |
0 |
|
|
209518 |
80682539 |
1 |
ON4C12H20 |
AB4C12D20 |
-16.87 |
4.1 |
-8.72 |
0.59 |
0 |
|
|
209519 |
80682679 |
1 |
O3N4C10H12 |
A3B4C10D12 |
-42.81 |
8.6 |
-8.97 |
-0.48 |
0 |
|
|
209520 |
80682680 |
1 |
ON5C8H15 |
AB5C8D15 |
1.26 |
5.89 |
-9.51 |
0.18 |
0 |
|
|
209521 |
80682681 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-14.66 |
9.55 |
-9.36 |
-0.71 |
0 |
|
|
209522 |
80683272 |
1 |
NOSC13H21 |
ABCD13E21 |
-43.95 |
1.42 |
-8.75 |
0.13 |
0 |
|
|
209523 |
80683273 |
1 |
OSN2C13H22 |
ABC2D13E22 |
-40.57 |
2.42 |
-8.75 |
-0.41 |
0 |
|
|
209524 |
80683274 |
1 |
SO3N5C12H15 |
AB3C5D12E15 |
-54.73 |
2.97 |
-9.5 |
-1.42 |
0 |
|
|
209525 |
80683275 |
1 |
O3N4C14H16 |
A3B4C14D16 |
-66.4 |
7.81 |
-9.25 |
-0.7 |
0 |
|
|
209526 |
80683380 |
1 |
ON5C15H19 |
AB5C15D19 |
22.94 |
4.22 |
-8.7 |
-0.08 |
0 |
|
|
209527 |
80683576 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-82.28 |
3.38 |
-9.08 |
0.87 |
0 |
|
|
209528 |
80683577 |
1 |
O3C11H20 |
A3B11C20 |
-160.07 |
4.92 |
-9.41 |
1.84 |
0 |
|
|
209529 |
80683578 |
1 |
F2O2N5C12H13 |
A2B2C5D12E13 |
-27.73 |
8.74 |
-9.46 |
-1.6 |
0 |
|
|
209530 |
80683579 |
1 |
N4C17H26 |
A4B17C26 |
42.5 |
5.06 |
-8.88 |
0.3 |
0 |
|
|
209531 |
80683580 |
1 |
SO4N5C11H15 |
AB4C5D11E15 |
-85.41 |
6.02 |
-9.25 |
-0.9 |
0 |
|
|
209532 |
80683842 |
1 |
ClN9C11H12 |
AB9C11D12 |
151.88 |
5.54 |
-9.9 |
-1.09 |
0 |
|
|
209533 |
80684153 |
1 |
O2N5C14H23 |
A2B5C14D23 |
-28.97 |
2.38 |
-8.96 |
0.68 |
0 |
|
|
209534 |
80684620 |
1 |
NO2C17H27 |
AB2C17D27 |
-84.73 |
2.48 |
-8.39 |
0.73 |
0 |
|
|
209535 |
80684746 |
1 |
NO2C14H27 |
AB2C14D27 |
-124.22 |
4.47 |
-8.63 |
2.18 |
0 |
|
|
209536 |
80685308 |
1 |
FO2C14H19 |
AB2C14D19 |
-141.05 |
2.04 |
-9.28 |
-0.07 |
0 |
|
|
209537 |
80685309 |
1 |
ON4C16H24 |
AB4C16D24 |
9.98 |
5.59 |
-8.62 |
0.29 |
0 |
|
|
209538 |
80685610 |
1 |
O2N5C14H19 |
A2B5C14D19 |
-21.6 |
5.39 |
-7.97 |
0.08 |
0 |
|
|
209539 |
80685611 |
1 |
O2N5C14H19 |
A2B5C14D19 |
-26.31 |
5.17 |
-8.31 |
0.08 |
0 |
|
|
209540 |
80686463 |
1 |
SN2O2C15H22 |
AB2C2D15E22 |
-56.8 |
6.93 |
-9.72 |
0.01 |
0 |
|
|
209541 |
80686464 |
1 |
SN2O2C14H20 |
AB2C2D14E20 |
-52.9 |
0.64 |
-9.63 |
0.14 |
0 |
|
|
209542 |
80686502 |
2 |
N3C6H7 |
A3B6C7 |
94.81 |
7.53 |
-8.05 |
-0.06 |
0 |
|
|
209543 |
80686503 |
1 |
N5C13H23 |
A5B13C23 |
41.41 |
4.09 |
-8.65 |
0.37 |
0 |
|
|
209544 |
80686581 |
1 |
SO3N6C9H12 |
AB3C6D9E12 |
-41.41 |
6.85 |
-9.37 |
-1.02 |
0 |