List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199445 |
79247072 |
1 |
ClNSO5C13H18 |
ABCD5E13F18 |
-206.96 |
3.98 |
-9.84 |
-1.46 |
0 |
|
|
199446 |
79247073 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-24.21 |
8.55 |
-9.11 |
-1.41 |
0 |
|
|
199447 |
79247074 |
1 |
ON2F3C11H15 |
AB2C3D11E15 |
-195.1 |
4.46 |
-9.04 |
-0.63 |
0 |
|
|
199448 |
79247075 |
1 |
SN2O3C12H16 |
AB2C3D12E16 |
-86.2 |
7.75 |
-9.85 |
-1.08 |
0 |
|
|
199449 |
79247076 |
1 |
NSO3C16H27 |
ABC3D16E27 |
-152.82 |
2.94 |
-9.57 |
-0.46 |
0 |
|
|
199450 |
79247651 |
1 |
O2N4C13H18 |
A2B4C13D18 |
-59.12 |
8.31 |
-8.73 |
-0.49 |
0 |
|
|
199451 |
79247652 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-83.53 |
3.62 |
-8.39 |
-0.09 |
0 |
|
|
199452 |
79247653 |
1 |
ON4C11H22 |
AB4C11D22 |
-31.17 |
2.15 |
-8.09 |
0.52 |
0 |
|
|
199453 |
79247658 |
1 |
OSN3C13H19 |
ABC3D13E19 |
-27.1 |
2.8 |
-8.23 |
-0.54 |
0 |
|
|
199454 |
79248077 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-19.07 |
7.64 |
-9.1 |
-0.43 |
0 |
|
|
199455 |
79248436 |
1 |
ON4C12H24 |
AB4C12D24 |
-41.05 |
3.75 |
-7.86 |
0.72 |
0 |
|
|
199456 |
79248437 |
1 |
FION2C11H16 |
ABCD2E11F16 |
-72.9 |
5.15 |
-8.43 |
-0.73 |
0 |
|
|
199457 |
79248440 |
1 |
NO2C16H25 |
AB2C16D25 |
-94.6 |
1.38 |
-8.41 |
0.44 |
0 |
|
|
199458 |
79248918 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-84.76 |
4.05 |
-9.45 |
-0.1 |
0 |
|
|
199459 |
79249565 |
1 |
NOC15H23 |
ABC15D23 |
-50.66 |
2.67 |
-8.8 |
0.49 |
0 |
|
|
199460 |
79249579 |
1 |
FNO2C13H20 |
ABC2D13E20 |
-137.75 |
3.34 |
-9.41 |
-0.2 |
0 |
|
|
199461 |
79250518 |
2 |
NOC5H11 |
ABC5D11 |
-124.05 |
3.37 |
-9.05 |
0.97 |
0 |
|
|
199462 |
79250631 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-72.16 |
4.29 |
-8.87 |
-0.09 |
0 |
|
|
199463 |
79250632 |
1 |
ON2C14H16 |
AB2C14D16 |
13.32 |
2.81 |
-8.77 |
0.17 |
0 |
|
|
199464 |
79250817 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-76.64 |
4.7 |
-8.84 |
0.06 |
0 |
|
|
199465 |
79251336 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-27.38 |
3.44 |
-8.86 |
0.1 |
0 |
|
|
199466 |
79251337 |
1 |
ON2Cl3H9C12 |
AB2C3D9E12 |
-8.3 |
3.12 |
-9.19 |
-0.89 |
0 |
|
|
199467 |
79251339 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-82.89 |
4.27 |
-8.73 |
0.2 |
0 |
|
|
199468 |
79251463 |
2 |
ON2C6H8 |
AB2C6D8 |
-65.89 |
2.48 |
-9.25 |
-0.11 |
0 |
|
|
199469 |
79251680 |
1 |
ION2H11C12 |
ABC2D11E12 |
31.13 |
4.5 |
-9.15 |
-0.87 |
0 |
|
|
199470 |
79251759 |
1 |
ON2C15H26 |
AB2C15D26 |
-53.45 |
3.24 |
-8.73 |
0.26 |
0 |
|
|
199471 |
79251760 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-27.62 |
3.55 |
-8.74 |
0.2 |
0 |
|
|
199472 |
79251761 |
1 |
ON2C15H18 |
AB2C15D18 |
-12.8 |
2.98 |
-8.53 |
-0.04 |
0 |
|
|
199473 |
79251875 |
1 |
SO2N3C9H9 |
AB2C3D9E9 |
-52.28 |
5.04 |
-9.21 |
-0.94 |
0 |
|
|
199474 |
79252305 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-133.97 |
4.95 |
-9.45 |
-0.48 |
0 |
|
|
199475 |
79252306 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-96.48 |
4.38 |
-9.74 |
-0.26 |
0 |
|
|
199476 |
79252413 |
2 |
FNO2C6H7 |
ABC2D6E7 |
-178.1 |
6.49 |
-10.23 |
-1.88 |
0 |
|
|
199477 |
79253196 |
1 |
NO3C16H25 |
AB3C16D25 |
-143.03 |
4.96 |
-9.15 |
0.16 |
0 |
|
|
199478 |
79253197 |
1 |
SN3O3C13H17 |
AB3C3D13E17 |
-101.46 |
3.03 |
-9.32 |
-1.34 |
0 |
|
|
199479 |
79253337 |
1 |
ON3C14H21 |
AB3C14D21 |
-18.56 |
2.81 |
-8.83 |
-0.65 |
0 |
|
|
199480 |
79253352 |
1 |
NOC13H29 |
ABC13D29 |
-104.63 |
3.49 |
-8.99 |
2.69 |
0 |
|
|
199481 |
79253897 |
1 |
NOC15H25 |
ABC15D25 |
-66.97 |
1.58 |
-8.77 |
0.42 |
0 |
|
|
199482 |
79253916 |
1 |
NO2C16H21 |
AB2C16D21 |
-72.94 |
4.22 |
-8.58 |
-0.51 |
0 |
|
|
199483 |
79253917 |
1 |
ON2C17H28 |
AB2C17D28 |
-46.59 |
4.18 |
-8.86 |
0.31 |
0 |
|
|
199484 |
79253918 |
1 |
N2O2C11H20 |
A2B2C11D20 |
-60.79 |
4.89 |
-9.33 |
0.15 |
0 |
|
|
199485 |
79253920 |
1 |
ON2C12H26 |
AB2C12D26 |
-75.84 |
2.98 |
-8.66 |
2.78 |
0 |
|
|
199486 |
79254090 |
1 |
NO2C16H31 |
AB2C16D31 |
-128.04 |
1.74 |
-8.78 |
2.28 |
0 |
|
|
199487 |
79254276 |
1 |
NOF3C12H22 |
ABC3D12E22 |
-251.11 |
4.09 |
-9.32 |
1.68 |
0 |
|
|
199488 |
79254874 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-1.45 |
5.05 |
-9.13 |
-0.19 |
0 |
|
|
199489 |
79254875 |
1 |
BrNO2C14H20 |
ABC2D14E20 |
-81.92 |
4.95 |
-8.89 |
-0.18 |
0 |
|
|
199490 |
79254876 |
1 |
NO2C15H25 |
AB2C15D25 |
-94.45 |
2.49 |
-8.78 |
0.1 |
0 |
|
|
199491 |
79254877 |
1 |
NOC10H23 |
ABC10D23 |
-88.46 |
3.47 |
-8.94 |
2.67 |
0 |
|
|
199492 |
79254878 |
1 |
NO2C10H21 |
AB2C10D21 |
-114.31 |
3.66 |
-9.34 |
2.24 |
0 |
|
|
199493 |
79255339 |
1 |
NSO4C13H19 |
ABC4D13E19 |
-161.04 |
7.4 |
-9.56 |
-0.6 |
0 |
|
|
199494 |
79255340 |
1 |
NSO5C13H21 |
ABC5D13E21 |
-204.56 |
7.27 |
-9.41 |
-0.42 |
0 |