List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
2674 |
8238 |
2 |
O4C12H15 |
A4B12C15 |
-341.97 |
11.79 |
-9.16 |
-1.11 |
0 |
|
|
2675 |
8240 |
1 |
BrNO4C17H22 |
ABC4D17E22 |
-141.22 |
6.61 |
-9.65 |
0.0 |
0 |
|
|
2676 |
8241 |
1 |
NO4C17H21 |
AB4C17D21 |
-112.02 |
2.32 |
-9.27 |
-0.06 |
0 |
|
|
2677 |
8242 |
1 |
NaO3H5C7 |
AB3C5D7 |
-145.6 |
6.24 |
-8.8 |
0.4 |
0 |
|
|
2679 |
8245 |
2 |
ON4C13H13 |
AB4C13D13 |
50.06 |
6.09 |
-8.4 |
-1.05 |
0 |
|
|
2680 |
8246 |
1 |
BrN2O2C12H19 |
AB2C2D12E19 |
-50.63 |
10.35 |
-7.32 |
-0.41 |
0 |
|
|
2681 |
8247 |
1 |
ON2C8H10 |
AB2C8D10 |
-7.24 |
2.98 |
-8.81 |
0.17 |
0 |
|
|
2682 |
8248 |
1 |
SO4N6C20H32 |
AB4C6D20E32 |
-95.43 |
3.92 |
-9.03 |
-0.26 |
0 |
|
|
2683 |
8258 |
1 |
OC5H8 |
AB5C8 |
-6.79 |
2.43 |
-10.59 |
1.35 |
0 |
|
|
2684 |
8259 |
1 |
OC2Cl3H3 |
AB2C3D3 |
-73.59 |
1.76 |
-11.12 |
-0.6 |
0 |
|
|
2685 |
8262 |
1 |
S2O4C7H16 |
A2B4C7D16 |
-194.61 |
0.06 |
-10.76 |
0.44 |
0 |
|
|
2686 |
8263 |
4 |
CF2 |
AB2 |
-380.27 |
0.01 |
-13.05 |
0.05 |
0 |
|
|
2687 |
8264 |
1 |
FOPN2C4H12 |
ABCD2E4F12 |
-167.91 |
3.62 |
-9.5 |
1.03 |
0 |
|
|
2688 |
8267 |
1 |
NSO2C13H19 |
ABC2D13E19 |
-71.96 |
4.88 |
-9.65 |
-0.77 |
0 |
|
|
2689 |
8269 |
1 |
NO5H19C24 |
AB5C19D24 |
-136.11 |
2.98 |
-9.02 |
-0.26 |
0 |
|
|
2690 |
8273 |
1 |
SBr2O5H16C21 |
AB2C5D16E21 |
-137.33 |
6.5 |
-9.22 |
-1.03 |
0 |
|
|
2691 |
8298 |
1 |
OC9H18 |
AB9C18 |
-90.87 |
2.33 |
-10.14 |
2.88 |
0 |
|
|
2692 |
8313 |
1 |
N2O3C5Cl6H6 |
A2B3C5D6E6 |
-181.28 |
2.57 |
-10.96 |
-0.8 |
0 |
|
|
2693 |
8315 |
1 |
Cl2O2C3H4 |
A2B2C3D4 |
-98.81 |
2.86 |
-11.0 |
-0.66 |
0 |
|
|
2694 |
8317 |
2 |
OH8C17 |
AB8C17 |
65.14 |
0.04 |
-8.53 |
-2.28 |
0 |
|
|
2695 |
8318 |
2 |
NO3H11C21 |
AB3C11D21 |
17.31 |
2.44 |
-7.69 |
-2.13 |
0 |
|
|
2696 |
8319 |
1 |
ClNO4H14C22 |
ABC4D14E22 |
-70.26 |
2.43 |
-8.75 |
-1.76 |
0 |
|
|
2697 |
8326 |
1 |
O3Cl4C8 |
A3B4C8 |
-95.91 |
4.78 |
-10.48 |
-2.49 |
0 |
|
|
2698 |
8332 |
1 |
NCl2O2H13C15 |
AB2C2D13E15 |
8.02 |
3.52 |
-9.63 |
-0.64 |
0 |
|
|
2699 |
8335 |
1 |
O5H14C17 |
A5B14C17 |
-137.24 |
3.74 |
-9.08 |
-0.93 |
0 |
|
|
2700 |
8336 |
1 |
NS2O6H9C10 |
AB2C6D9E10 |
-205.88 |
4.55 |
-9.22 |
-1.67 |
0 |
|
|
2701 |
8338 |
1 |
NS2O6H9C10 |
AB2C6D9E10 |
-214.72 |
3.1 |
-9.31 |
-1.6 |
0 |
|
|
2702 |
8340 |
1 |
NO5H19C20 |
AB5C19D20 |
-73.48 |
14.13 |
-7.8 |
-1.43 |
0 |
|
|
2703 |
8341 |
1 |
NO2H9C14 |
AB2C9D14 |
-15.19 |
2.45 |
-9.01 |
-1.52 |
0 |
|
|
2704 |
8342 |
2 |
ClOH2C5 |
ABC2D5 |
-31.49 |
3.51 |
-10.13 |
-2.2 |
0 |
|
|
2705 |
8344 |
2 |
O3C7H9 |
A3B7C9 |
-226.18 |
2.65 |
-9.85 |
-1.0 |
0 |
|
|
2706 |
8345 |
2 |
O3C10H15 |
A3B10C15 |
-260.91 |
1.98 |
-9.68 |
-0.69 |
0 |
|
|
2707 |
8346 |
2 |
O2C12H19 |
A2B12C19 |
-212.04 |
3.14 |
-10.34 |
-0.9 |
0 |
|
|
2708 |
8348 |
1 |
O2H10C13 |
A2B10C13 |
-25.1 |
4.39 |
-9.45 |
-0.6 |
0 |
|
|
2709 |
8349 |
1 |
NS3H9O9C10 |
AB3C9D9E10 |
-339.72 |
3.43 |
-9.71 |
-2.1 |
0 |
|
|
2710 |
8353 |
1 |
NSO4C12H13 |
ABC4D12E13 |
-133.49 |
8.24 |
-8.46 |
-1.07 |
0 |
|
|
2711 |
8354 |
1 |
NO3H7C9 |
AB3C7D9 |
-90.05 |
4.43 |
-10.61 |
-1.56 |
0 |
|
|
2712 |
8357 |
1 |
O5C10H12 |
A5B10C12 |
-171.34 |
6.08 |
-8.94 |
-0.77 |
0 |
|
|
2713 |
8359 |
1 |
NO3H5C8 |
AB3C5D8 |
-94.55 |
7.01 |
-9.9 |
-1.32 |
0 |
|
|
2714 |
8363 |
1 |
O3H12C14 |
A3B12C14 |
-76.75 |
3.62 |
-9.49 |
-0.61 |
0 |
|
|
2715 |
8364 |
1 |
O3C15H22 |
A3B15C22 |
-136.33 |
2.81 |
-9.49 |
-0.49 |
0 |
|
|
2716 |
8366 |
2 |
NOC7H10 |
ABC7D10 |
-80.64 |
3.01 |
-8.55 |
-0.17 |
0 |
|
|
2717 |
8367 |
2 |
NC6H8 |
AB6C8 |
22.14 |
2.95 |
-8.34 |
0.06 |
0 |
|
|
2718 |
8368 |
1 |
Cl2H6C7 |
A2B6C7 |
-4.93 |
0.73 |
-9.65 |
-0.39 |
0 |
|
|
2719 |
8369 |
3 |
OC2H2 |
AB2C2 |
-89.47 |
5.61 |
-9.27 |
-0.48 |
0 |
|
|
2720 |
8370 |
6 |
CCl |
AB |
-10.02 |
0.0 |
-9.83 |
-1.43 |
0 |
|
|
2721 |
8374 |
1 |
ClO2H5C7 |
AB2C5D7 |
-67.83 |
5.62 |
-10.24 |
-1.06 |
0 |
|
|
2722 |
8377 |
1 |
ClN2H3O6C7 |
AB2C3D6E7 |
-62.44 |
2.12 |
-11.38 |
-2.62 |
0 |
|
|
2723 |
8381 |
1 |
PSN2O4C14H17 |
ABC2D4E14F17 |
-183.56 |
5.28 |
-8.8 |
-1.28 |
0 |
|
|
2724 |
8398 |
1 |
O2C23H32 |
A2B23C32 |
-113.64 |
3.05 |
-8.22 |
0.21 |
0 |