List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
259350 |
103164483 |
2 |
NOC7H8 |
ABC7D8 |
-32.31 |
3.27 |
-8.37 |
-0.22 |
0 |
|
|
259351 |
103164490 |
1 |
BrON3C13H16 |
ABC3D13E16 |
15.14 |
6.54 |
-9.4 |
-0.87 |
0 |
|
|
259352 |
103164508 |
1 |
BrON2C14H17 |
ABC2D14E17 |
-2.56 |
4.83 |
-9.09 |
-0.52 |
0 |
|
|
259353 |
103164520 |
1 |
ON3C14H19 |
AB3C14D19 |
1.93 |
5.97 |
-9.01 |
-0.34 |
0 |
|
|
259354 |
103164521 |
1 |
ON3C13H17 |
AB3C13D17 |
5.97 |
4.0 |
-8.7 |
-0.42 |
0 |
|
|
259355 |
103164546 |
2 |
ON2C6H8 |
AB2C6D8 |
-65.67 |
5.47 |
-9.25 |
-0.63 |
0 |
|
|
259356 |
103164548 |
1 |
O3N4C13H18 |
A3B4C13D18 |
-103.29 |
6.51 |
-9.25 |
-0.66 |
0 |
|
|
259357 |
103164549 |
1 |
Cl2N3C11H11 |
A2B3C11D11 |
45.44 |
7.15 |
-9.31 |
-1.04 |
0 |
|
|
259358 |
103164550 |
1 |
OCl2N3C13H15 |
AB2C3D13E15 |
0.36 |
8.01 |
-9.32 |
-1.04 |
0 |
|
|
259359 |
103164566 |
1 |
N2O2C13H14 |
A2B2C13D14 |
-41.93 |
5.8 |
-9.58 |
-0.95 |
0 |
|
|
259360 |
103164588 |
1 |
NO2C12H23 |
AB2C12D23 |
-110.88 |
5.3 |
-9.33 |
1.36 |
0 |
|
|
259361 |
103164594 |
1 |
NO2C11H19 |
AB2C11D19 |
-81.94 |
5.19 |
-9.73 |
0.59 |
0 |
|
|
259362 |
103164619 |
1 |
NOC14H27 |
ABC14D27 |
-86.16 |
3.71 |
-9.6 |
1.32 |
0 |
|
|
259363 |
103164643 |
1 |
NO3C15H27 |
AB3C15D27 |
-159.76 |
3.43 |
-9.41 |
1.1 |
0 |
|
|
259364 |
103164678 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-98.35 |
1.12 |
-9.12 |
0.98 |
0 |
|
|
259365 |
103164700 |
1 |
NO4C11H21 |
AB4C11D21 |
-191.97 |
4.89 |
-9.77 |
0.72 |
0 |
|
|
259366 |
103164710 |
1 |
NO2C12H21 |
AB2C12D21 |
-96.16 |
4.3 |
-9.56 |
0.9 |
0 |
|
|
259367 |
103164726 |
1 |
NO3C10H19 |
AB3C10D19 |
-157.52 |
5.49 |
-9.94 |
0.81 |
0 |
|
|
259368 |
103164734 |
1 |
NO2C11H21 |
AB2C11D21 |
-117.31 |
2.43 |
-9.69 |
1.26 |
0 |
|
|
259369 |
103164735 |
1 |
NO3C13H25 |
AB3C13D25 |
-164.23 |
7.09 |
-9.73 |
0.98 |
0 |
|
|
259370 |
103164758 |
1 |
NO3C13H25 |
AB3C13D25 |
-155.27 |
4.03 |
-9.46 |
1.23 |
0 |
|
|
259371 |
103164769 |
1 |
NO3C13H23 |
AB3C13D23 |
-143.54 |
5.15 |
-9.76 |
0.98 |
0 |
|
|
259372 |
103164806 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-4.6 |
3.87 |
-8.58 |
-0.44 |
0 |
|
|
259373 |
103164817 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-74.8 |
3.8 |
-9.25 |
0.8 |
0 |
|
|
259374 |
103164821 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-104.16 |
2.23 |
-8.85 |
-0.39 |
0 |
|
|
259375 |
103164836 |
2 |
NOC8H10 |
ABC8D10 |
-63.69 |
5.73 |
-9.06 |
-0.36 |
0 |
|
|
259376 |
103164854 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-76.46 |
3.23 |
-8.77 |
0.53 |
0 |
|
|
259377 |
103164871 |
2 |
NOC6H11 |
ABC6D11 |
-96.73 |
4.55 |
-9.57 |
1.07 |
0 |
|
|
259378 |
103164872 |
1 |
ON2C10H18 |
AB2C10D18 |
-49.7 |
3.4 |
-9.55 |
1.11 |
0 |
|
|
259379 |
103164873 |
2 |
NOC8H14 |
ABC8D14 |
-108.14 |
3.66 |
-9.16 |
1.17 |
0 |
|
|
259380 |
103164874 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-105.6 |
5.24 |
-9.07 |
1.25 |
0 |
|
|
259381 |
103164911 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-80.57 |
5.23 |
-9.38 |
0.08 |
0 |
|
|
259382 |
103164917 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-62.81 |
3.71 |
-8.38 |
-0.1 |
0 |
|
|
259383 |
103164922 |
1 |
ON2C16H22 |
AB2C16D22 |
-25.59 |
5.44 |
-8.52 |
0.24 |
0 |
|
|
259384 |
103164936 |
1 |
ON2C13H24 |
AB2C13D24 |
-71.47 |
4.52 |
-9.16 |
1.07 |
0 |
|
|
259385 |
103164944 |
1 |
ON2C9H18 |
AB2C9D18 |
-60.46 |
3.81 |
-9.57 |
1.43 |
0 |
|
|
259386 |
103164947 |
2 |
NOC7H13 |
ABC7D13 |
-105.44 |
4.16 |
-9.0 |
1.04 |
0 |
|
|
259387 |
103164951 |
1 |
N2O3C16H30 |
A2B3C16D30 |
-158.11 |
2.01 |
-9.39 |
1.16 |
0 |
|
|
259388 |
103164952 |
1 |
N2O2C15H28 |
A2B2C15D28 |
-116.16 |
6.22 |
-9.24 |
1.34 |
0 |
|
|
259389 |
103164961 |
1 |
N2O2C15H28 |
A2B2C15D28 |
-111.33 |
5.14 |
-9.29 |
1.26 |
0 |
|
|
259390 |
103164989 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-114.44 |
3.77 |
-9.43 |
1.26 |
0 |
|
|
259391 |
103165035 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-54.92 |
5.54 |
-9.54 |
0.52 |
0 |
|
|
259392 |
103165076 |
2 |
NOC6H11 |
ABC6D11 |
-97.34 |
6.58 |
-9.4 |
1.09 |
0 |
|
|
259393 |
103165086 |
2 |
NOC8H15 |
ABC8D15 |
-120.02 |
2.89 |
-9.39 |
1.22 |
0 |
|
|
259394 |
103165103 |
1 |
N2O3C13H26 |
A2B3C13D26 |
-153.95 |
2.76 |
-9.47 |
1.17 |
0 |
|
|
259395 |
103165163 |
1 |
NO4C15H25 |
AB4C15D25 |
-166.93 |
3.46 |
-9.63 |
0.26 |
0 |
|
|
259396 |
103165167 |
1 |
NO6C14H23 |
AB6C14D23 |
-265.34 |
6.84 |
-9.89 |
0.0 |
0 |
|
|
259397 |
103165236 |
1 |
NSO2C15H19 |
ABC2D15E19 |
-13.42 |
4.5 |
-9.28 |
-0.83 |
0 |
|
|
259398 |
103165243 |
1 |
NSO2C15H19 |
ABC2D15E19 |
-36.84 |
4.42 |
-9.03 |
-0.57 |
0 |
|
|
259399 |
103165247 |
1 |
FNO2C15H16 |
ABC2D15E16 |
-79.81 |
5.82 |
-8.97 |
-0.64 |
0 |