List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
251400 |
103103729 |
1 |
O3N4C12H16 |
A3B4C12D16 |
-66.64 |
3.86 |
-9.39 |
-0.89 |
0 |
|
|
251401 |
103103730 |
1 |
O3N4C9H18 |
A3B4C9D18 |
-102.15 |
6.63 |
-9.37 |
0.38 |
0 |
|
|
251402 |
103103733 |
1 |
O3N4C11H22 |
A3B4C11D22 |
-111.08 |
3.33 |
-9.5 |
0.35 |
0 |
|
|
251403 |
103103734 |
1 |
O3N4C13H26 |
A3B4C13D26 |
-121.46 |
3.13 |
-9.47 |
0.39 |
0 |
|
|
251404 |
103103738 |
1 |
O2N5C9H15 |
A2B5C9D15 |
-51.14 |
5.11 |
-9.26 |
0.01 |
0 |
|
|
251405 |
103103740 |
1 |
O2N4C5H12 |
A2B4C5D12 |
-75.88 |
2.8 |
-9.86 |
0.29 |
0 |
|
|
251406 |
103103742 |
1 |
SO3N4C9H16 |
AB3C4D9E16 |
-110.16 |
5.46 |
-9.94 |
-0.43 |
0 |
|
|
251407 |
103103750 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-81.8 |
1.87 |
-8.63 |
0.22 |
0 |
|
|
251408 |
103103751 |
1 |
N2O4C9H14 |
A2B4C9D14 |
-162.76 |
4.07 |
-10.04 |
-0.26 |
0 |
|
|
251409 |
103103752 |
1 |
N2O4C9H16 |
A2B4C9D16 |
-187.58 |
1.59 |
-9.95 |
0.05 |
0 |
|
|
251410 |
103103754 |
1 |
N3O4C11H13 |
A3B4C11D13 |
-136.72 |
8.43 |
-10.0 |
-1.18 |
0 |
|
|
251411 |
103103771 |
1 |
O4N5C9H13 |
A4B5C9D13 |
-111.7 |
6.93 |
-10.44 |
-1.02 |
0 |
|
|
251412 |
103103772 |
1 |
N3O4C9H17 |
A3B4C9D17 |
-186.77 |
4.48 |
-9.74 |
0.14 |
0 |
|
|
251413 |
103103794 |
2 |
ON2C6H7 |
AB2C6D7 |
-38.97 |
3.63 |
-9.59 |
-0.82 |
0 |
|
|
251414 |
103103796 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-109.36 |
2.32 |
-9.38 |
-0.75 |
0 |
|
|
251415 |
103103809 |
1 |
SN2O3C13H16 |
AB2C3D13E16 |
-74.42 |
1.88 |
-9.31 |
-1.1 |
0 |
|
|
251416 |
103103811 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-78.27 |
1.27 |
-9.49 |
-0.56 |
0 |
|
|
251417 |
103103814 |
1 |
SN2O3C12H14 |
AB2C3D12E14 |
-66.58 |
2.72 |
-9.61 |
-1.03 |
0 |
|
|
251418 |
103103835 |
1 |
FN2O3C15H17 |
AB2C3D15E17 |
-117.35 |
2.65 |
-9.61 |
-0.87 |
0 |
|
|
251419 |
103103847 |
1 |
ClN2O3C14H15 |
AB2C3D14E15 |
-67.79 |
2.06 |
-9.76 |
-1.14 |
0 |
|
|
251420 |
103103861 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-20.71 |
2.16 |
-9.14 |
-0.48 |
0 |
|
|
251421 |
103103865 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-55.53 |
3.15 |
-9.16 |
-0.62 |
0 |
|
|
251422 |
103103866 |
1 |
SO2N3C12H15 |
AB2C3D12E15 |
-25.43 |
0.64 |
-9.53 |
-1.2 |
0 |
|
|
251423 |
103103867 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-38.58 |
1.41 |
-9.54 |
-0.6 |
0 |
|
|
251424 |
103103869 |
1 |
FO2N3C14H16 |
AB2C3D14E16 |
-63.64 |
1.51 |
-9.85 |
-0.93 |
0 |
|
|
251425 |
103103874 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-25.62 |
1.34 |
-9.46 |
-0.66 |
0 |
|
|
251426 |
103103875 |
1 |
ClO2N3C14H16 |
AB2C3D14E16 |
-23.97 |
1.52 |
-9.71 |
-1.08 |
0 |
|
|
251427 |
103103878 |
1 |
BrSN2O3C10H13 |
ABC2D3E10F13 |
-101.13 |
5.33 |
-9.74 |
-1.13 |
0 |
|
|
251428 |
103103879 |
1 |
BrClN2S2O3C8H10 |
ABC2D2E3F8G10 |
-91.83 |
4.44 |
-9.76 |
-1.7 |
0 |
|
|
251429 |
103103889 |
1 |
BrSN2O3C10H13 |
ABC2D3E10F13 |
-102.05 |
6.16 |
-8.98 |
-1.07 |
0 |
|
|
251430 |
103103890 |
1 |
BrSN3O3C9H12 |
ABC3D3E9F12 |
-89.84 |
4.11 |
-9.9 |
-1.53 |
0 |
|
|
251431 |
103103891 |
1 |
BrSCl2N2O3C10H11 |
ABC2D2E3F10G11 |
-109.41 |
4.85 |
-9.78 |
-1.63 |
0 |
|
|
251432 |
103103892 |
1 |
BrN2S2O3C8H11 |
AB2C2D3E8F11 |
-87.34 |
5.46 |
-9.67 |
-1.49 |
0 |
|
|
251433 |
103103893 |
1 |
ClSN2O4C13H15 |
ABC2D4E13F15 |
-103.49 |
5.73 |
-9.67 |
-1.48 |
0 |
|
|
251434 |
103103896 |
1 |
FSN2O4C13H15 |
ABC2D4E13F15 |
-146.05 |
6.38 |
-9.65 |
-1.5 |
0 |
|
|
251435 |
103103912 |
1 |
SN3O3C13H17 |
AB3C3D13E17 |
-54.8 |
5.43 |
-9.61 |
-1.2 |
0 |
|
|
251436 |
103103920 |
1 |
N3O3C12H17 |
A3B3C12D17 |
-114.72 |
2.22 |
-8.71 |
-0.56 |
0 |
|
|
251437 |
103103921 |
1 |
N3O3C11H15 |
A3B3C11D15 |
-111.86 |
4.95 |
-8.77 |
-0.58 |
0 |
|
|
251438 |
103103935 |
1 |
N3O3C12H17 |
A3B3C12D17 |
-110.2 |
2.86 |
-9.14 |
-0.66 |
0 |
|
|
251439 |
103103948 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-126.85 |
1.92 |
-8.97 |
-0.04 |
0 |
|
|
251440 |
103103962 |
1 |
BrON3C9H12 |
ABC3D9E12 |
-13.66 |
4.56 |
-9.26 |
-0.73 |
0 |
|
|
251441 |
103103980 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-118.1 |
1.19 |
-9.69 |
-1.76 |
0 |
|
|
251442 |
103103987 |
2 |
NO2C7H8 |
AB2C7D8 |
-136.13 |
5.79 |
-9.98 |
-1.26 |
0 |
|
|
251443 |
103103999 |
1 |
ION2C11H15 |
ABC2D11E15 |
-12.84 |
4.77 |
-9.24 |
-0.78 |
0 |
|
|
251444 |
103104000 |
1 |
OSN2C13H18 |
ABC2D13E18 |
-30.75 |
5.07 |
-8.25 |
0.23 |
0 |
|
|
251445 |
103104009 |
1 |
BrClON2C11H14 |
ABCD2E11F14 |
-33.83 |
4.07 |
-8.99 |
-0.35 |
0 |
|
|
251446 |
103104014 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-27.92 |
4.16 |
-8.98 |
-0.3 |
0 |
|
|
251447 |
103104021 |
1 |
FON3C14H18 |
ABC3D14E18 |
-24.6 |
4.67 |
-9.3 |
-0.75 |
0 |
|
|
251448 |
103104026 |
1 |
FON3C14H18 |
ABC3D14E18 |
-37.04 |
4.75 |
-9.31 |
-0.77 |
0 |
|
|
251449 |
103104033 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-61.75 |
4.09 |
-8.63 |
-0.06 |
0 |