List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
261900 |
103258013 |
1 |
SO2N4C11H14 |
AB2C4D11E14 |
-10.94 |
2.96 |
-9.05 |
-1.14 |
0 |
|
|
261901 |
103258039 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-62.81 |
2.25 |
-9.09 |
-1.64 |
0 |
|
|
261902 |
103258133 |
1 |
NSO2C15H17 |
ABC2D15E17 |
-47.08 |
3.65 |
-9.14 |
-1.15 |
0 |
|
|
261903 |
103258138 |
1 |
NO2C13H17 |
AB2C13D17 |
-61.37 |
7.31 |
-9.58 |
-0.11 |
0 |
|
|
261904 |
103258200 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-72.02 |
5.69 |
-9.76 |
-0.81 |
0 |
|
|
261905 |
103258201 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-66.09 |
4.92 |
-9.5 |
-0.66 |
0 |
|
|
261906 |
103258203 |
1 |
O2N5C12H15 |
A2B5C12D15 |
4.23 |
6.55 |
-9.94 |
-0.81 |
0 |
|
|
261907 |
103258424 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-89.3 |
6.69 |
-9.12 |
-1.34 |
0 |
|
|
261908 |
103258441 |
1 |
NO4C8H15 |
AB4C8D15 |
-187.13 |
4.21 |
-9.71 |
0.31 |
0 |
|
|
261909 |
103258567 |
1 |
NO3C14H19 |
AB3C14D19 |
-101.28 |
4.52 |
-8.53 |
-0.14 |
0 |
|
|
261910 |
103258695 |
1 |
FNO2C15H22 |
ABC2D15E22 |
-138.51 |
3.57 |
-9.39 |
-0.3 |
0 |
|
|
261911 |
103258696 |
1 |
FO2N3C14H14 |
AB2C3D14E14 |
-72.87 |
4.39 |
-10.13 |
-1.37 |
0 |
|
|
261912 |
103258758 |
1 |
FNO2C12H14 |
ABC2D12E14 |
-101.14 |
5.88 |
-9.9 |
-0.38 |
0 |
|
|
261913 |
103258808 |
1 |
N3O3H13C15 |
A3B3C13D15 |
-4.22 |
6.94 |
-9.45 |
-1.0 |
0 |
|
|
261914 |
103258824 |
1 |
NO3C16H19 |
AB3C16D19 |
-97.77 |
6.98 |
-9.32 |
-0.24 |
0 |
|
|
261915 |
103258835 |
1 |
NO3C16H19 |
AB3C16D19 |
-90.97 |
8.29 |
-9.19 |
-0.63 |
0 |
|
|
261916 |
103258880 |
1 |
NO2C13H17 |
AB2C13D17 |
-71.2 |
5.77 |
-8.89 |
-0.09 |
0 |
|
|
261917 |
103258899 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-100.92 |
3.04 |
-10.24 |
-0.4 |
0 |
|
|
261918 |
103258901 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-72.35 |
4.75 |
-9.7 |
-0.78 |
0 |
|
|
261919 |
103259004 |
1 |
NO4C13H21 |
AB4C13D21 |
-164.32 |
6.53 |
-9.4 |
-0.77 |
0 |
|
|
261920 |
103259016 |
1 |
O2N3C9H21 |
A2B3C9D21 |
-113.48 |
2.98 |
-9.45 |
0.98 |
0 |
|
|
261921 |
103259188 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-86.76 |
5.4 |
-9.72 |
-0.84 |
0 |
|
|
261922 |
103259189 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-127.18 |
5.55 |
-9.51 |
-0.25 |
0 |
|
|
261923 |
103259225 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-90.55 |
5.8 |
-9.72 |
-0.7 |
0 |
|
|
261924 |
103259330 |
1 |
BrClNO2H15C16 |
ABCD2E15F16 |
-56.69 |
3.41 |
-9.19 |
-0.67 |
0 |
|
|
261925 |
103259337 |
1 |
NSO3C13H15 |
ABC3D13E15 |
-72.77 |
2.86 |
-8.83 |
-0.86 |
0 |
|
|
261926 |
103259450 |
1 |
BrNSO2C11H14 |
ABCD2E11F14 |
-46.83 |
1.81 |
-9.27 |
-0.57 |
0 |
|
|
261927 |
103259466 |
1 |
BrNSO2H12C16 |
ABCD2E12F16 |
-12.15 |
6.98 |
-8.49 |
-1.51 |
0 |
|
|
261928 |
103259474 |
1 |
BrNO2H10C13 |
ABC2D10E13 |
-32.91 |
5.62 |
-8.98 |
-1.29 |
0 |
|
|
261929 |
103259583 |
1 |
BrClNO2H11C14 |
ABCD2E11F14 |
-43.9 |
4.96 |
-9.28 |
-0.88 |
0 |
|
|
261930 |
103259587 |
1 |
BrClNO2C12H13 |
ABCD2E12F13 |
-66.07 |
5.81 |
-8.94 |
-0.45 |
0 |
|
|
261931 |
103259613 |
1 |
NSO3C10H15 |
ABC3D10E15 |
-111.67 |
3.79 |
-8.79 |
-0.08 |
0 |
|
|
261932 |
103259617 |
1 |
NSO3C12H13 |
ABC3D12E13 |
-73.2 |
4.23 |
-8.91 |
-0.53 |
0 |
|
|
261933 |
103259806 |
1 |
NO3C17H27 |
AB3C17D27 |
-134.22 |
7.51 |
-9.17 |
-0.69 |
0 |
|
|
261934 |
103259841 |
1 |
NO3C10H17 |
AB3C10D17 |
-114.95 |
4.92 |
-9.76 |
-0.35 |
0 |
|
|
261935 |
103259865 |
1 |
NO3C10H17 |
AB3C10D17 |
-113.27 |
4.37 |
-9.66 |
0.37 |
0 |
|
|
261936 |
103259867 |
1 |
NO3C12H23 |
AB3C12D23 |
-152.03 |
2.85 |
-9.33 |
0.89 |
0 |
|
|
261937 |
103260070 |
1 |
NO3C11H15 |
AB3C11D15 |
-94.87 |
4.09 |
-9.44 |
0.31 |
0 |
|
|
261938 |
103260137 |
1 |
ClO2N3C14H14 |
AB2C3D14E14 |
-27.41 |
3.34 |
-9.31 |
-1.5 |
0 |
|
|
261939 |
103260192 |
1 |
ClNO3C15H16 |
ABC3D15E16 |
-89.47 |
6.41 |
-9.5 |
-0.71 |
0 |
|
|
261940 |
103260374 |
1 |
NO3C10H19 |
AB3C10D19 |
-136.82 |
5.93 |
-9.9 |
0.82 |
0 |
|
|
261941 |
103260399 |
1 |
NSO3C12H19 |
ABC3D12E19 |
-131.62 |
6.68 |
-9.59 |
-1.3 |
0 |
|
|
261942 |
103260440 |
1 |
NF2O2C5H7 |
AB2C2D5E7 |
-181.63 |
5.33 |
-9.73 |
-0.36 |
0 |
|
|
261943 |
103260490 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-121.26 |
3.29 |
-8.06 |
0.27 |
0 |
|
|
261944 |
103260538 |
1 |
BrN2O2C12H21 |
AB2C2D12E21 |
-100.72 |
2.63 |
-8.32 |
-0.56 |
0 |
|
|
261945 |
103260574 |
1 |
BrN2O2C11H21 |
AB2C2D11E21 |
-108.46 |
2.84 |
-8.39 |
-0.61 |
0 |
|
|
261946 |
103260660 |
1 |
BrNO3H12C13 |
ABC3D12E13 |
-80.09 |
4.72 |
-8.5 |
-0.69 |
0 |
|
|
261947 |
103260692 |
1 |
BrNSO2C14H14 |
ABCD2E14F14 |
-52.09 |
4.33 |
-9.06 |
-1.1 |
0 |
|
|
261948 |
103261008 |
1 |
N2O2F3C6H11 |
A2B2C3D6E11 |
-233.63 |
4.4 |
-8.92 |
-0.04 |
0 |
|
|
261949 |
103261079 |
2 |
NOC6H11 |
ABC6D11 |
-88.22 |
4.5 |
-8.64 |
-0.2 |
0 |