List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
417020 |
135091100 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-77.3 |
3.28 |
-9.25 |
0.48 |
0 |
|
|
417021 |
135091101 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-5.74 |
4.27 |
-8.37 |
-0.01 |
0 |
|
|
417022 |
135091103 |
2 |
ON3C9H15 |
AB3C9D15 |
-60.33 |
3.59 |
-8.67 |
0.28 |
0 |
|
|
417023 |
135091104 |
1 |
N2O5C20H28 |
A2B5C20D28 |
-204.11 |
1.63 |
-8.42 |
0.02 |
0 |
|
|
417024 |
135091105 |
1 |
ClO2N4C19H23 |
AB2C4D19E23 |
-57.06 |
4.99 |
-9.34 |
-0.61 |
0 |
|
|
417025 |
135091113 |
1 |
NO3C22H27 |
AB3C22D27 |
-113.18 |
4.0 |
-9.05 |
0.08 |
0 |
|
|
417026 |
135091117 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-48.96 |
2.04 |
-9.02 |
-0.28 |
0 |
|
|
417027 |
135091119 |
1 |
FOSN2C20H25 |
ABCD2E20F25 |
-41.56 |
2.6 |
-8.88 |
-0.09 |
0 |
|
|
417028 |
135091121 |
1 |
O3N4C17H24 |
A3B4C17D24 |
-85.7 |
5.91 |
-9.43 |
-0.56 |
0 |
|
|
417029 |
135091136 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-30.94 |
2.07 |
-8.94 |
-0.52 |
0 |
|
|
417030 |
135091139 |
1 |
ClN3O4C18H22 |
AB3C4D18E22 |
-101.09 |
2.74 |
-9.55 |
-1.18 |
0 |
|
|
417031 |
135091140 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-90.68 |
2.5 |
-8.62 |
-0.71 |
0 |
|
|
417032 |
135091141 |
1 |
ClON4C17H23 |
ABC4D17E23 |
-20.89 |
3.45 |
-8.95 |
-0.6 |
0 |
|
|
417033 |
135091142 |
1 |
NSO3C20H23 |
ABC3D20E23 |
-88.36 |
6.49 |
-8.96 |
-0.25 |
0 |
|
|
417034 |
135091143 |
1 |
F2O2N3C17H19 |
A2B2C3D17E19 |
-137.54 |
4.92 |
-9.36 |
0.01 |
0 |
|
|
417035 |
135091144 |
2 |
N2O2C11H15 |
A2B2C11D15 |
-94.42 |
2.08 |
-9.08 |
-0.87 |
0 |
|
|
417036 |
135091145 |
1 |
O2N3F6H15C16 |
A2B3C6D15E16 |
-365.84 |
1.27 |
-9.69 |
-1.31 |
0 |
|
|
417037 |
135091146 |
3 |
N2O2C11H16 |
A2B2C11D16 |
-271.45 |
8.46 |
-9.44 |
0.12 |
0 |
|
|
417038 |
135091147 |
1 |
OSN4C15H18 |
ABC4D15E18 |
13.0 |
4.97 |
-8.73 |
-0.39 |
0 |
|
|
417039 |
135091148 |
1 |
SN2O4C18H26 |
AB2C4D18E26 |
-168.65 |
2.01 |
-9.57 |
-0.72 |
0 |
|
|
417040 |
135091149 |
1 |
OF3N3C20H24 |
AB3C3D20E24 |
-175.51 |
7.89 |
-8.98 |
-0.98 |
0 |
|
|
417041 |
135091150 |
1 |
N4O4C19H28 |
A4B4C19D28 |
-138.58 |
2.86 |
-9.77 |
-0.03 |
0 |
|
|
417042 |
135091196 |
1 |
O4N8C31H38 |
A4B8C31D38 |
-75.64 |
8.97 |
-8.25 |
-0.76 |
0 |
|
|
417043 |
135091214 |
1 |
NO4C23H27 |
AB4C23D27 |
-155.83 |
5.6 |
-9.29 |
-0.32 |
0 |
|
|
417044 |
135091215 |
1 |
O2N5C18H19 |
A2B5C18D19 |
33.7 |
3.48 |
-9.27 |
-0.9 |
0 |
|
|
417045 |
135091216 |
1 |
N5O7C34H47 |
A5B7C34D47 |
-277.19 |
3.19 |
-8.81 |
-0.81 |
0 |
|
|
417046 |
135091217 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-25.05 |
9.31 |
-8.83 |
-0.57 |
0 |
|
|
417047 |
135091218 |
1 |
N3O5C21H29 |
A3B5C21D29 |
-210.95 |
9.47 |
-9.29 |
-0.61 |
0 |
|
|
417049 |
135091226 |
1 |
FO2N3C15H18 |
AB2C3D15E18 |
-54.63 |
3.28 |
-9.65 |
-0.25 |
0 |
|
|
417050 |
135091228 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-81.22 |
1.83 |
-8.9 |
-1.0 |
0 |
|
|
417051 |
135091229 |
1 |
SN4O4C15H26 |
AB4C4D15E26 |
-155.89 |
8.32 |
-9.33 |
0.32 |
0 |
|
|
417052 |
135091230 |
1 |
ON4C19H26 |
AB4C19D26 |
46.71 |
3.65 |
-8.99 |
-0.28 |
0 |
|
|
417053 |
135091231 |
1 |
N5C22H23 |
A5B22C23 |
99.52 |
2.66 |
-8.65 |
-0.85 |
0 |
|
|
417054 |
135091232 |
1 |
NSO3C18H27 |
ABC3D18E27 |
-146.15 |
1.04 |
-9.05 |
-0.23 |
0 |
|
|
417055 |
135091233 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-91.68 |
5.93 |
-8.06 |
0.29 |
0 |
|
|
417056 |
135091234 |
1 |
ClNO5C18H26 |
ABC5D18E26 |
-212.59 |
2.32 |
-9.07 |
-0.34 |
0 |
|
|
417057 |
135091235 |
1 |
FN2O5C19H23 |
AB2C5D19E23 |
-190.57 |
4.66 |
-9.23 |
-1.44 |
0 |
|
|
417058 |
135091236 |
1 |
O6N7C31H45 |
A6B7C31D45 |
-262.02 |
3.6 |
-8.65 |
-0.21 |
0 |
|
|
417059 |
135091237 |
1 |
NO2C21H31 |
AB2C21D31 |
-115.87 |
4.71 |
-8.72 |
0.7 |
0 |
|
|
417060 |
135091238 |
1 |
N3O4C18H21 |
A3B4C18D21 |
-79.73 |
5.85 |
-9.15 |
-1.03 |
0 |
|
|
417061 |
135091239 |
1 |
O5N7C35H41 |
A5B7C35D41 |
-161.93 |
6.12 |
-8.45 |
-1.55 |
0 |
|
|
417062 |
135091240 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-50.46 |
9.13 |
-9.34 |
-0.78 |
0 |
|
|
417063 |
135091241 |
1 |
N3O3C23H29 |
A3B3C23D29 |
-84.32 |
2.28 |
-8.28 |
-0.43 |
0 |
|
|
417064 |
135091242 |
1 |
ClN2O4C18H21 |
AB2C4D18E21 |
-130.96 |
7.46 |
-8.8 |
-0.5 |
0 |
|
|
417065 |
135091243 |
1 |
SO4N5C30H37 |
AB4C5D30E37 |
-140.45 |
10.09 |
-8.3 |
-0.48 |
0 |
|
|
417066 |
135091244 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-74.98 |
9.3 |
-8.58 |
-0.4 |
0 |
|
|
417067 |
135091245 |
1 |
ON6C15H16 |
AB6C15D16 |
61.33 |
6.46 |
-9.16 |
-0.8 |
0 |
|
|
417068 |
135091246 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-82.52 |
2.57 |
-9.18 |
-0.21 |
0 |
|
|
417069 |
135091247 |
1 |
N6O7C37H52 |
A6B7C37D52 |
-229.4 |
4.81 |
-8.67 |
-0.49 |
0 |
|
|
417070 |
135091248 |
1 |
S2O7N8C38H46 |
A2B7C8D38E46 |
-206.33 |
12.51 |
-8.39 |
-1.57 |
0 |