List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
211345 |
80933329 |
1 |
ClN4C14H17 |
AB4C14D17 |
31.56 |
2.73 |
-8.53 |
-0.25 |
0 |
|
|
211346 |
80933521 |
1 |
N4C15H26 |
A4B15C26 |
-14.88 |
2.86 |
-8.63 |
0.52 |
0 |
|
|
211347 |
80935543 |
1 |
ClON3C12H18 |
ABC3D12E18 |
-25.99 |
3.93 |
-9.02 |
-0.37 |
0 |
|
|
211348 |
80935965 |
2 |
N2C6H7 |
A2B6C7 |
49.39 |
1.33 |
-9.38 |
-0.13 |
0 |
|
|
211349 |
80936208 |
1 |
ClON5C10H10 |
ABC5D10E10 |
32.58 |
3.04 |
-10.17 |
-1.54 |
0 |
|
|
211350 |
80936499 |
1 |
N5C11H15 |
A5B11C15 |
56.73 |
2.16 |
-8.93 |
-0.37 |
0 |
|
|
211351 |
80936500 |
1 |
N5C11H15 |
A5B11C15 |
49.98 |
2.33 |
-9.05 |
-0.43 |
0 |
|
|
211352 |
80936971 |
1 |
N5C12H23 |
A5B12C23 |
20.96 |
4.3 |
-8.86 |
0.06 |
0 |
|
|
211353 |
80937132 |
1 |
N5C14H25 |
A5B14C25 |
18.42 |
4.81 |
-8.75 |
0.17 |
0 |
|
|
211354 |
80937844 |
1 |
ON6C12H22 |
AB6C12D22 |
-16.73 |
0.23 |
-9.22 |
-0.21 |
0 |
|
|
211355 |
80937845 |
1 |
FN5C13H16 |
AB5C13D16 |
12.43 |
0.75 |
-8.94 |
-0.37 |
0 |
|
|
211356 |
80937846 |
1 |
N5C15H19 |
A5B15C19 |
81.25 |
2.7 |
-9.11 |
0.04 |
0 |
|
|
211357 |
80937852 |
1 |
N6C11H22 |
A6B11C22 |
31.15 |
3.95 |
-8.87 |
0.16 |
0 |
|
|
211358 |
80938270 |
1 |
O2S2N4C13H22 |
A2B2C4D13E22 |
-59.8 |
3.11 |
-8.91 |
0.0 |
0 |
|
|
211359 |
80938293 |
1 |
N6C13H24 |
A6B13C24 |
26.02 |
2.72 |
-8.7 |
0.05 |
0 |
|
|
211360 |
80938294 |
1 |
N7C8H11 |
A7B8C11 |
104.46 |
1.87 |
-9.78 |
-1.16 |
0 |
|
|
211361 |
80938360 |
1 |
ClN3C11H16 |
AB3C11D16 |
32.7 |
4.77 |
-9.04 |
-0.24 |
0 |
|
|
211362 |
80938361 |
1 |
F3N4C14H15 |
A3B4C14D15 |
-119.92 |
5.67 |
-8.97 |
-0.61 |
0 |
|
|
211363 |
80938362 |
1 |
N4C17H24 |
A4B17C24 |
19.18 |
2.27 |
-8.38 |
0.0 |
0 |
|
|
211364 |
80938682 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-39.36 |
2.44 |
-8.6 |
0.1 |
0 |
|
|
211365 |
80938693 |
1 |
ON4C16H18 |
AB4C16D18 |
33.08 |
7.75 |
-9.26 |
-0.69 |
0 |
|
|
211366 |
80938772 |
1 |
ClN4C14H23 |
AB4C14D23 |
8.16 |
5.85 |
-8.9 |
-0.2 |
0 |
|
|
211367 |
80939185 |
1 |
N4C17H22 |
A4B17C22 |
26.58 |
3.83 |
-8.44 |
0.1 |
0 |
|
|
211368 |
80939281 |
1 |
ON4C16H22 |
AB4C16D22 |
-5.35 |
3.19 |
-8.09 |
0.15 |
0 |
|
|
211369 |
80939923 |
1 |
ClOSN4C14H17 |
ABCD4E14F17 |
-0.28 |
8.03 |
-9.79 |
-1.25 |
0 |
|
|
211370 |
80940019 |
1 |
ClFN4C15H18 |
ABC4D15E18 |
-18.64 |
4.33 |
-8.72 |
-0.48 |
0 |
|
|
211371 |
80940020 |
1 |
Br2N4C15H18 |
A2B4C15D18 |
36.79 |
4.83 |
-8.7 |
-0.57 |
0 |
|
|
211372 |
80940219 |
1 |
ON3C17H23 |
AB3C17D23 |
-12.36 |
4.09 |
-8.71 |
-0.24 |
0 |
|
|
211373 |
80941037 |
1 |
ClF2N3H12C13 |
AB2C3D12E13 |
-49.81 |
2.78 |
-9.23 |
-0.89 |
0 |
|
|
211374 |
80941106 |
1 |
O2N5C11H15 |
A2B5C11D15 |
-68.58 |
4.97 |
-9.46 |
-0.14 |
0 |
|
|
211375 |
80941107 |
1 |
ON5C13H23 |
AB5C13D23 |
-31.48 |
0.83 |
-8.75 |
0.29 |
0 |
|
|
211376 |
80941489 |
1 |
BrFN4C14H16 |
ABC4D14E16 |
-4.17 |
6.34 |
-8.76 |
-0.5 |
0 |
|
|
211377 |
80941762 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-83.42 |
3.18 |
-8.98 |
0.17 |
0 |
|
|
211378 |
80942051 |
1 |
ON4H12C13 |
AB4C12D13 |
47.08 |
2.53 |
-9.55 |
-0.76 |
0 |
|
|
211379 |
80942106 |
2 |
N2C8H15 |
A2B8C15 |
-27.69 |
3.61 |
-8.97 |
0.31 |
0 |
|
|
211380 |
80942449 |
1 |
N4C17H32 |
A4B17C32 |
-33.29 |
2.47 |
-8.6 |
0.58 |
0 |
|
|
211381 |
80942450 |
1 |
ON3C12H21 |
AB3C12D21 |
-45.9 |
1.61 |
-8.89 |
0.26 |
0 |
|
|
211382 |
80942451 |
1 |
ON3C11H19 |
AB3C11D19 |
-38.54 |
1.91 |
-9.05 |
0.18 |
0 |
|
|
211383 |
80942895 |
2 |
ON3C5H9 |
AB3C5D9 |
-32.39 |
2.36 |
-9.46 |
-0.15 |
0 |
|
|
211384 |
80942896 |
1 |
ON7C12H21 |
AB7C12D21 |
9.04 |
5.45 |
-9.08 |
0.15 |
0 |
|
|
211385 |
80942897 |
1 |
N6C13H20 |
A6B13C20 |
55.03 |
2.37 |
-8.36 |
-0.33 |
0 |
|
|
211386 |
80942898 |
1 |
O2N6C11H12 |
A2B6C11D12 |
69.14 |
5.91 |
-9.44 |
-1.13 |
0 |
|
|
211387 |
80942899 |
1 |
FN6C11H13 |
AB6C11D13 |
26.75 |
2.05 |
-9.05 |
-0.26 |
0 |
|
|
211388 |
80942932 |
1 |
N5C16H23 |
A5B16C23 |
51.46 |
4.78 |
-8.91 |
0.05 |
0 |
|
|
211389 |
80942933 |
1 |
N5C16H23 |
A5B16C23 |
52.56 |
4.56 |
-8.92 |
0.02 |
0 |
|
|
211390 |
80943918 |
1 |
ON5C15H25 |
AB5C15D25 |
-40.36 |
2.47 |
-8.76 |
0.29 |
0 |
|
|
211391 |
80943925 |
1 |
N5C16H29 |
A5B16C29 |
5.79 |
3.45 |
-8.54 |
0.48 |
0 |
|
|
211392 |
80944044 |
1 |
ON7C11H23 |
AB7C11D23 |
7.63 |
6.12 |
-8.88 |
0.03 |
0 |
|
|
211393 |
80944045 |
1 |
FN5C11H12 |
AB5C11D12 |
33.45 |
4.19 |
-9.39 |
-0.51 |
0 |
|
|
211394 |
80944046 |
1 |
FO2N4C13H13 |
AB2C4D13E13 |
7.93 |
4.76 |
-8.68 |
-0.96 |
0 |
|
|
211395 |
80944047 |
1 |
FN5C11H18 |
AB5C11D18 |
-12.0 |
4.89 |
-8.9 |
-0.26 |
0 |
|
|
211396 |
80944048 |
1 |
N5C12H21 |
A5B12C21 |
21.14 |
4.01 |
-8.75 |
0.02 |
0 |
|
|
211397 |
80944205 |
1 |
ON5C12H23 |
AB5C12D23 |
-16.93 |
3.85 |
-8.86 |
-0.03 |
0 |
|
|
211398 |
80944612 |
1 |
ClN3C15H16 |
AB3C15D16 |
39.74 |
4.4 |
-8.85 |
-0.38 |
0 |
|
|
211399 |
80944662 |
1 |
ON5C9H17 |
AB5C9D17 |
1.89 |
6.49 |
-8.91 |
0.0 |
0 |
|
|
211400 |
80944663 |
1 |
ON5C15H27 |
AB5C15D27 |
-46.02 |
3.33 |
-8.44 |
0.27 |
0 |
|
|
211401 |
80944700 |
1 |
O2N4C13H20 |
A2B4C13D20 |
6.21 |
4.61 |
-8.52 |
-0.81 |
0 |
|
|
211402 |
80944704 |
1 |
N7C10H21 |
A7B10C21 |
43.79 |
3.63 |
-8.93 |
0.34 |
0 |
|
|
211403 |
80944842 |
1 |
N5C16H27 |
A5B16C27 |
76.96 |
1.92 |
-8.42 |
0.4 |
0 |
|
|
211404 |
80944843 |
1 |
ON5C7H13 |
AB5C7D13 |
0.88 |
4.54 |
-9.19 |
-0.25 |
0 |
|
|
211405 |
80944909 |
1 |
ClN4C13H21 |
AB4C13D21 |
9.16 |
4.41 |
-8.73 |
-0.33 |
0 |
|
|
211406 |
80944910 |
1 |
ClN3C13H14 |
AB3C13D14 |
34.67 |
3.31 |
-8.97 |
-0.53 |
0 |
|
|
211407 |
80945140 |
1 |
ClN4C16H17 |
AB4C16D17 |
68.72 |
3.53 |
-9.29 |
-0.62 |
0 |
|
|
211408 |
80945141 |
1 |
ClN4H15C16 |
AB4C15D16 |
102.51 |
3.53 |
-9.34 |
-0.66 |
0 |
|
|
211409 |
80945142 |
1 |
ClON3C16H20 |
ABC3D16E20 |
-15.89 |
4.96 |
-8.78 |
-0.28 |
0 |
|
|
211410 |
80945143 |
1 |
ClON3C16H18 |
ABC3D16E18 |
16.6 |
5.88 |
-8.95 |
-0.36 |
0 |
|
|
211411 |
80945303 |
1 |
N4C13H24 |
A4B13C24 |
-5.13 |
2.88 |
-8.52 |
0.56 |
0 |
|
|
211412 |
80945330 |
1 |
ClSO2N3C12H18 |
ABC2D3E12F18 |
-85.25 |
6.25 |
-9.38 |
-0.4 |
0 |
|
|
211413 |
80945331 |
1 |
BrClSN3C12H13 |
ABCD3E12F13 |
51.21 |
2.73 |
-9.67 |
-0.81 |
0 |
|
|
211414 |
80945332 |
1 |
ClO2N3C13H20 |
AB2C3D13E20 |
-93.16 |
4.83 |
-9.48 |
-0.43 |
0 |
|
|
211415 |
80945670 |
1 |
ClN4C12H15 |
AB4C12D15 |
49.86 |
5.13 |
-9.56 |
-0.74 |
0 |
|
|
211416 |
80945671 |
1 |
ClN4C13H17 |
AB4C13D17 |
45.17 |
5.14 |
-9.53 |
-0.72 |
0 |
|
|
211417 |
80945672 |
1 |
ClON2C15H17 |
ABC2D15E17 |
-3.26 |
1.01 |
-9.06 |
-0.74 |
0 |
|
|
211418 |
80945673 |
1 |
ClN4C12H15 |
AB4C12D15 |
43.76 |
5.36 |
-9.34 |
-0.98 |
0 |
|
|
211419 |
80946811 |
1 |
ClN3C17H22 |
AB3C17D22 |
26.24 |
4.25 |
-9.06 |
-0.28 |
0 |