List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
316015 |
126629666 |
3 |
NH11C16 |
AB11C16 |
221.64 |
3.82 |
-7.72 |
-0.57 |
0 |
|
|
316017 |
126629669 |
1 |
ClSO5N7C24H34 |
ABC5D7E24F34 |
-124.03 |
8.7 |
-8.03 |
-0.41 |
0 |
|
|
316019 |
126629675 |
1 |
O5N6C34H48 |
A5B6C34D48 |
-169.25 |
4.65 |
-9.19 |
-1.05 |
0 |
|
|
316020 |
126629676 |
1 |
Cl2O2F3N3H6C9 |
A2B2C3D3E6F9 |
-179.51 |
3.9 |
-10.16 |
-1.55 |
0 |
|
|
316021 |
126629679 |
1 |
SCl2N3O3C9H11 |
AB2C3D3E9F11 |
-95.17 |
4.95 |
-9.67 |
-1.08 |
0 |
|
|
316022 |
126629680 |
1 |
ClFSN3O3C9H11 |
ABCD3E3F9G11 |
-129.67 |
5.12 |
-9.89 |
-1.05 |
0 |
|
|
316024 |
126629682 |
1 |
Cl2O2F3N3H10C11 |
A2B2C3D3E10F11 |
-208.21 |
4.79 |
-9.82 |
-1.24 |
0 |
|
|
316025 |
126629685 |
1 |
ClFSO2N4C8H10 |
ABCD2E4F8G10 |
-71.74 |
6.27 |
-9.67 |
-0.98 |
0 |
|
|
316026 |
126629693 |
1 |
ClSO4N8C27H41 |
ABC4D8E27F41 |
-134.75 |
9.39 |
-7.89 |
-0.21 |
0 |
|
|
316030 |
126629714 |
1 |
NO2H17C24 |
AB2C17D24 |
46.71 |
0.99 |
-7.99 |
-0.4 |
0 |
|
|
316031 |
126629715 |
1 |
NO2H29C39 |
AB2C29D39 |
81.44 |
0.59 |
-7.9 |
-0.52 |
0 |
|
|
316032 |
126629716 |
2 |
NOH12C16 |
ABC12D16 |
67.47 |
4.03 |
-8.22 |
-0.67 |
0 |
|
|
316034 |
126629724 |
1 |
NO2H29C39 |
AB2C29D39 |
81.19 |
0.4 |
-7.9 |
-0.5 |
0 |
|
|
316037 |
126629728 |
1 |
O2N3H31C48 |
A2B3C31D48 |
164.89 |
3.57 |
-7.83 |
-0.59 |
0 |
|
|
316038 |
126629733 |
1 |
NO3H23C36 |
AB3C23D36 |
67.33 |
1.54 |
-8.04 |
-0.72 |
0 |
|
|
316040 |
126629736 |
2 |
NOH13C20 |
ABC13D20 |
123.85 |
1.34 |
-7.8 |
-0.6 |
0 |
|
|
316041 |
126629737 |
1 |
NO2H25C38 |
AB2C25D38 |
99.74 |
0.38 |
-7.95 |
-0.68 |
0 |
|
|
316042 |
126629738 |
1 |
NO2H35C53 |
AB2C35D53 |
167.78 |
0.54 |
-7.95 |
-0.58 |
0 |
|
|
316043 |
126629739 |
1 |
FN2O2H27C42 |
AB2C2D27E42 |
80.79 |
3.36 |
-7.83 |
-0.55 |
0 |
|
|
316046 |
126629764 |
1 |
NO4H21C36 |
AB4C21D36 |
43.49 |
1.48 |
-8.04 |
-0.81 |
0 |
|
|
316047 |
126629765 |
1 |
NO4H21C36 |
AB4C21D36 |
42.19 |
1.51 |
-8.1 |
-0.82 |
0 |
|
|
316048 |
126629774 |
1 |
NO4H23C36 |
AB4C23D36 |
36.38 |
0.58 |
-8.01 |
-0.61 |
0 |
|
|
316049 |
126629794 |
1 |
N2O2H38C55 |
A2B2C38D55 |
159.32 |
2.06 |
-7.75 |
-0.65 |
0 |
|
|
316050 |
126629808 |
1 |
NO3H31C49 |
AB3C31D49 |
125.8 |
1.44 |
-8.0 |
-0.75 |
0 |
|
|
316051 |
126629815 |
1 |
NO5H21C36 |
AB5C21D36 |
11.15 |
1.48 |
-8.05 |
-0.79 |
0 |
|
|
316052 |
126629816 |
1 |
NO3H27C42 |
AB3C27D42 |
94.03 |
0.81 |
-8.12 |
-0.62 |
0 |
|
|
316053 |
126629817 |
1 |
NO4H31C49 |
AB4C31D49 |
98.25 |
0.26 |
-7.94 |
-0.63 |
0 |
|
|
316054 |
126629823 |
1 |
NO3H31C45 |
AB3C31D45 |
80.15 |
1.45 |
-7.96 |
-0.68 |
0 |
|
|
316055 |
126629825 |
1 |
FN2O2H31C48 |
AB2C2D31E48 |
105.37 |
3.21 |
-7.78 |
-0.57 |
0 |
|
|
316056 |
126629835 |
1 |
FO2C12H13 |
AB2C12D13 |
-96.38 |
5.02 |
-9.12 |
-0.56 |
0 |
|
|
316057 |
126629836 |
1 |
NO5C13H21 |
AB5C13D21 |
-244.88 |
2.15 |
-10.13 |
0.05 |
0 |
|
|
316060 |
126629842 |
2 |
BrN2O2H8C10 |
AB2C2D8E10 |
-22.78 |
4.11 |
-9.59 |
-1.86 |
0 |
|
|
316061 |
126629851 |
1 |
NO2H25C33 |
AB2C25D33 |
52.05 |
0.48 |
-7.95 |
-0.56 |
0 |
|
|
316063 |
126629857 |
1 |
ON2H42C60 |
AB2C42D60 |
224.07 |
2.31 |
-7.78 |
-0.46 |
0 |
|
|
316064 |
126629858 |
1 |
N5O6C31H49 |
A5B6C31D49 |
-267.85 |
10.5 |
-8.85 |
-0.06 |
0 |
|
|
316065 |
126629875 |
1 |
NO2C9H17 |
AB2C9D17 |
-93.05 |
4.88 |
-9.92 |
0.94 |
0 |
|
|
316066 |
126629883 |
1 |
N5O5C31H41 |
A5B5C31D41 |
-161.81 |
3.01 |
-8.74 |
-0.87 |
0 |
|
|
316067 |
126629903 |
1 |
ClN5O6C36H46 |
AB5C6D36E46 |
-245.21 |
2.52 |
-9.05 |
-0.95 |
0 |
|
|
316068 |
126629906 |
1 |
N5O6C31H43 |
A5B6C31D43 |
-242.88 |
4.59 |
-8.74 |
-0.89 |
0 |
|
|
316069 |
126629925 |
1 |
NF3C9H10 |
AB3C9D10 |
-107.41 |
4.17 |
-9.75 |
-0.44 |
0 |
|
|
316070 |
126629927 |
1 |
Cl3N5O6C31H40 |
A3B5C6D31E40 |
-256.43 |
3.86 |
-9.14 |
-0.55 |
0 |
|
|
316071 |
126629928 |
1 |
FIOC3H4 |
ABCD3E4 |
-56.35 |
0.5 |
-10.29 |
-1.68 |
0 |
|
|
316072 |
126629930 |
1 |
N4O5C20H36 |
A4B5C20D36 |
-254.07 |
1.39 |
-8.62 |
0.32 |
0 |
|
|
316073 |
126629935 |
1 |
ClN4O6C22H39 |
AB4C6D22E39 |
-333.17 |
1.79 |
-8.94 |
0.34 |
0 |
|
|
316075 |
126629942 |
1 |
N5O5C28H43 |
A5B5C28D43 |
-208.54 |
6.84 |
-8.78 |
-0.1 |
0 |
|
|
316076 |
126629955 |
1 |
O5C18H30 |
A5B18C30 |
-234.22 |
1.16 |
-9.84 |
-0.12 |
0 |
|
|
316077 |
126629958 |
1 |
Cl3N5O6C31H40 |
A3B5C6D31E40 |
-258.57 |
2.31 |
-9.34 |
-0.62 |
0 |
|
|
316078 |
126629959 |
1 |
N5O6C29H39 |
A5B6C29D39 |
-227.75 |
4.65 |
-9.31 |
-0.56 |
0 |
|
|
316079 |
126629960 |
1 |
Cl3N5O5C32H42 |
A3B5C5D32E42 |
-221.37 |
3.63 |
-9.2 |
-0.55 |
0 |
|
|
316080 |
126629970 |
1 |
Cl3N3O4C18H30 |
A3B3C4D18E30 |
-228.3 |
2.8 |
-9.27 |
-0.45 |
0 |