List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
205945 |
80181231 |
1 |
SN2O2C15H24 |
AB2C2D15E24 |
-89.93 |
2.52 |
-8.47 |
0.24 |
0 |
|
|
205946 |
80181350 |
1 |
O2C11H16 |
A2B11C16 |
-84.35 |
2.3 |
-9.35 |
-0.03 |
0 |
|
|
205947 |
80181391 |
1 |
ON4C14H22 |
AB4C14D22 |
-28.9 |
2.27 |
-9.65 |
-0.2 |
0 |
|
|
205948 |
80181985 |
1 |
NO2C15H17 |
AB2C15D17 |
-45.58 |
4.89 |
-9.39 |
-0.09 |
0 |
|
|
205949 |
80182267 |
1 |
NO4C11H19 |
AB4C11D19 |
-204.71 |
7.04 |
-10.12 |
0.55 |
0 |
|
|
205950 |
80182349 |
1 |
NO5C11H17 |
AB5C11D17 |
-221.13 |
7.56 |
-9.73 |
0.32 |
0 |
|
|
205951 |
80182366 |
1 |
N2O2C15H16 |
A2B2C15D16 |
-17.92 |
1.76 |
-9.27 |
-0.71 |
0 |
|
|
205952 |
80182395 |
1 |
SN2O2C13H16 |
AB2C2D13E16 |
-64.89 |
5.7 |
-8.49 |
-0.75 |
0 |
|
|
205953 |
80182396 |
1 |
SN2O2C14H24 |
AB2C2D14E24 |
-110.05 |
7.17 |
-8.59 |
-0.3 |
0 |
|
|
205954 |
80182458 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-123.92 |
2.55 |
-9.03 |
1.4 |
0 |
|
|
205955 |
80182459 |
1 |
NOC17H27 |
ABC17D27 |
-68.23 |
3.18 |
-8.52 |
0.71 |
0 |
|
|
205956 |
80182967 |
1 |
NOC18H27 |
ABC18D27 |
-50.38 |
1.44 |
-8.7 |
0.55 |
0 |
|
|
205957 |
80182968 |
1 |
NO2C17H25 |
AB2C17D25 |
-88.37 |
2.85 |
-8.86 |
0.19 |
0 |
|
|
205958 |
80182969 |
1 |
NOC16H25 |
ABC16D25 |
-56.51 |
1.31 |
-8.89 |
0.6 |
0 |
|
|
205959 |
80182970 |
1 |
ON2C17H22 |
AB2C17D22 |
-18.47 |
3.48 |
-9.03 |
-0.44 |
0 |
|
|
205960 |
80183093 |
1 |
BrN2C15H23 |
AB2C15D23 |
-1.85 |
2.01 |
-8.8 |
0.0 |
0 |
|
|
205961 |
80184220 |
2 |
N2C8H13 |
A2B8C13 |
15.53 |
3.58 |
-7.96 |
0.98 |
0 |
|
|
205962 |
80184535 |
1 |
OF2N2C12H14 |
AB2C2D12E14 |
-109.55 |
3.98 |
-8.59 |
-0.24 |
0 |
|
|
205963 |
80184536 |
1 |
ClFNOC17H19 |
ABCDE17F19 |
-53.16 |
2.72 |
-8.82 |
-0.43 |
0 |
|
|
205964 |
80184537 |
1 |
ClFNC17H21 |
ABCD17E21 |
-62.29 |
1.19 |
-9.42 |
-0.52 |
0 |
|
|
205965 |
80184714 |
1 |
NF2O3C15H17 |
AB2C3D15E17 |
-213.61 |
4.54 |
-9.38 |
-0.31 |
0 |
|
|
205966 |
80184789 |
1 |
ON2C15H26 |
AB2C15D26 |
-58.58 |
6.9 |
-9.52 |
0.94 |
0 |
|
|
205967 |
80184790 |
2 |
NOC6H10 |
ABC6D10 |
-87.79 |
1.19 |
-9.67 |
0.82 |
0 |
|
|
205968 |
80185084 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-131.0 |
9.13 |
-9.54 |
-0.66 |
0 |
|
|
205969 |
80185222 |
1 |
NO4C12H23 |
AB4C12D23 |
-201.41 |
3.9 |
-9.43 |
0.55 |
0 |
|
|
205970 |
80185223 |
1 |
OF2N2C14H16 |
AB2C2D14E16 |
-105.99 |
1.56 |
-9.92 |
-0.56 |
0 |
|
|
205971 |
80185224 |
2 |
NOC6H11 |
ABC6D11 |
-91.22 |
7.89 |
-9.59 |
0.98 |
0 |
|
|
205972 |
80185225 |
1 |
ClFN5C14H15 |
ABC5D14E15 |
5.23 |
3.33 |
-9.19 |
-0.75 |
0 |
|
|
205973 |
80185226 |
1 |
O2N4C9H14 |
A2B4C9D14 |
-53.58 |
6.77 |
-9.48 |
-0.14 |
0 |
|
|
205974 |
80185227 |
1 |
OF2N4H8C10 |
AB2C4D8E10 |
-60.98 |
5.49 |
-9.69 |
-0.88 |
0 |
|
|
205975 |
80185228 |
1 |
NF2O3C14H17 |
AB2C3D14E17 |
-217.15 |
4.24 |
-9.78 |
-0.46 |
0 |
|
|
205976 |
80185229 |
1 |
BrNOF2H12C15 |
ABCD2E12F15 |
-92.48 |
3.34 |
-9.73 |
-0.54 |
0 |
|
|
205977 |
80185860 |
1 |
ClFON2C11H12 |
ABCD2E11F12 |
-64.51 |
4.16 |
-9.16 |
-0.55 |
0 |
|
|
205978 |
80185917 |
1 |
BrClNOF2H9C14 |
ABCDE2F9G14 |
-100.74 |
2.2 |
-9.3 |
-0.78 |
0 |
|
|
205979 |
80185973 |
1 |
BrNOF2H14C16 |
ABCD2E14F16 |
-91.22 |
5.32 |
-9.73 |
-0.54 |
0 |
|
|
205980 |
80186183 |
1 |
NO2C15H23 |
AB2C15D23 |
-85.72 |
3.47 |
-9.56 |
-0.31 |
0 |
|
|
205981 |
80186184 |
1 |
NO3C10H19 |
AB3C10D19 |
-152.39 |
4.0 |
-9.52 |
0.9 |
0 |
|
|
205982 |
80186185 |
1 |
NO2C14H25 |
AB2C14D25 |
-127.69 |
2.28 |
-9.32 |
1.08 |
0 |
|
|
205983 |
80186321 |
1 |
BrN3C12H16 |
AB3C12D16 |
20.43 |
3.98 |
-8.83 |
-0.35 |
0 |
|
|
205984 |
80186343 |
1 |
FION2C12H14 |
ABCD2E12F14 |
-38.83 |
2.55 |
-8.96 |
-0.98 |
0 |
|
|
205985 |
80186344 |
1 |
NOF2C17H17 |
ABC2D17E17 |
-113.7 |
3.48 |
-9.54 |
-0.5 |
0 |
|
|
205986 |
80186345 |
1 |
BrON3C12H16 |
ABC3D12E16 |
-0.63 |
1.28 |
-8.98 |
-0.58 |
0 |
|
|
205987 |
80186346 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-39.32 |
0.84 |
-9.0 |
-0.38 |
0 |
|
|
205988 |
80186347 |
1 |
FN2O2C13H17 |
AB2C2D13E17 |
-103.55 |
6.26 |
-8.11 |
0.06 |
0 |
|
|
205989 |
80186348 |
1 |
FSN2C12H15 |
ABC2D12E15 |
-18.94 |
1.47 |
-8.52 |
-0.1 |
0 |
|
|
205990 |
80186476 |
1 |
NSO5C14H21 |
ABC5D14E21 |
-198.98 |
6.94 |
-9.44 |
-0.59 |
0 |
|
|
205991 |
80187366 |
1 |
SO2N4C14H20 |
AB2C4D14E20 |
-48.04 |
3.41 |
-8.68 |
-0.66 |
0 |
|
|
205992 |
80187367 |
1 |
SN3O4C13H19 |
AB3C4D13E19 |
-83.12 |
4.87 |
-9.13 |
-1.61 |
0 |
|
|
205993 |
80187547 |
2 |
NOC8H14 |
ABC8D14 |
-134.3 |
6.51 |
-9.69 |
1.0 |
0 |
|
|
205994 |
80187548 |
1 |
NO3C13H25 |
AB3C13D25 |
-161.49 |
5.75 |
-9.41 |
1.13 |
0 |