List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
432999 |
135173136 |
2 |
NH14C21 |
AB14C21 |
197.7 |
2.72 |
-8.13 |
-0.46 |
0 |
|
|
433000 |
135173137 |
1 |
O3C16H18 |
A3B16C18 |
-72.11 |
2.93 |
-8.23 |
0.18 |
0 |
|
|
433001 |
135173138 |
1 |
NSO2C8H11 |
ABC2D8E11 |
-61.06 |
4.04 |
-8.01 |
-0.07 |
0 |
|
|
433002 |
135173139 |
1 |
NOPH28C36 |
ABCD28E36 |
157.21 |
4.78 |
-8.11 |
-0.62 |
0 |
|
|
433003 |
135173140 |
1 |
N4H30C39 |
A4B30C39 |
210.72 |
2.23 |
-7.98 |
-1.19 |
0 |
|
|
433004 |
135173141 |
1 |
FO2N9H30C31 |
AB2C9D30E31 |
104.02 |
8.77 |
-8.83 |
-2.35 |
0 |
|
|
433005 |
135173142 |
1 |
NH29C42 |
AB29C42 |
184.26 |
2.98 |
-8.91 |
-0.57 |
0 |
|
|
433006 |
135173143 |
1 |
N4H26C39 |
A4B26C39 |
222.74 |
2.25 |
-8.96 |
-1.14 |
0 |
|
|
433007 |
135173144 |
2 |
NC5H9 |
AB5C9 |
-12.36 |
2.67 |
-9.18 |
1.28 |
0 |
|
|
433008 |
135173145 |
1 |
NOH23C36 |
ABC23D36 |
136.67 |
3.27 |
-8.93 |
-0.72 |
0 |
|
|
433009 |
135173146 |
1 |
FO2N9C35H36 |
AB2C9D35E36 |
64.25 |
1.11 |
-8.71 |
-2.39 |
0 |
|
|
433010 |
135173147 |
1 |
SO3N6C19H22 |
AB3C6D19E22 |
-30.47 |
4.89 |
-8.62 |
-0.62 |
0 |
|
|
433011 |
135173148 |
2 |
OC9H14 |
AB9C14 |
-124.98 |
2.27 |
-9.2 |
0.31 |
0 |
|
|
433012 |
135173149 |
1 |
FON10H25C26 |
ABC10D25E26 |
123.14 |
7.44 |
-8.61 |
-2.61 |
0 |
|
|
433013 |
135173150 |
1 |
O4C27H40 |
A4B27C40 |
-166.38 |
3.67 |
-8.47 |
0.22 |
0 |
|
|
433014 |
135173151 |
1 |
OSN2C9H16 |
ABC2D9E16 |
-3.75 |
5.42 |
-8.91 |
0.11 |
0 |
|
|
433015 |
135173152 |
1 |
N3O5C30H57 |
A3B5C30D57 |
-215.87 |
4.93 |
-8.83 |
0.7 |
0 |
|
|
433016 |
135173153 |
1 |
N5O5C33H65 |
A5B5C33D65 |
-220.55 |
5.9 |
-9.04 |
1.34 |
0 |
|
|
433017 |
135173154 |
1 |
SO3N5C20H23 |
AB3C5D20E23 |
-40.56 |
6.58 |
-8.87 |
-0.79 |
0 |
|
|
433018 |
135173155 |
1 |
NPO4C8H12 |
ABC4D8E12 |
-195.64 |
3.56 |
-9.09 |
-0.33 |
0 |
|
|
433019 |
135173156 |
2 |
O2H6C7 |
A2B6C7 |
-125.97 |
2.99 |
-9.02 |
-0.85 |
0 |
|
|
433020 |
135173157 |
1 |
FO2N9C34H36 |
AB2C9D34E36 |
58.07 |
7.88 |
-8.88 |
-2.51 |
0 |
|
|
433021 |
135173158 |
1 |
NSO2C11H15 |
ABC2D11E15 |
-82.5 |
1.61 |
-8.64 |
-0.25 |
0 |
|
|
433022 |
135173159 |
1 |
O3C14H28 |
A3B14C28 |
-202.09 |
3.75 |
-10.23 |
1.62 |
0 |
|
|
433023 |
135173160 |
1 |
NC13H25 |
AB13C25 |
-17.85 |
2.51 |
-9.33 |
1.08 |
0 |
|
|
433024 |
135173161 |
1 |
NO2C9H11 |
AB2C9D11 |
-47.46 |
3.75 |
-8.09 |
0.11 |
0 |
|
|
433025 |
135173162 |
1 |
O4C17H20 |
A4B17C20 |
-118.77 |
0.79 |
-8.2 |
0.37 |
0 |
|
|
433026 |
135173163 |
1 |
FSN8H15C21 |
ABC8D15E21 |
194.53 |
5.91 |
-8.69 |
-2.17 |
0 |
|
|
433027 |
135173164 |
1 |
SN3O4C30H33 |
AB3C4D30E33 |
-97.55 |
3.49 |
-8.87 |
-0.98 |
0 |
|
|
433028 |
135173165 |
1 |
ON4H20C22 |
AB4C20D22 |
67.42 |
3.65 |
-8.36 |
-0.39 |
0 |
|
|
433029 |
135173166 |
1 |
IO2F3N3H7C12 |
AB2C3D3E7F12 |
-69.65 |
3.48 |
-9.86 |
-1.71 |
0 |
|
|
433030 |
135173167 |
1 |
BrClNC11H13 |
ABCD11E13 |
8.48 |
4.32 |
-9.41 |
-0.57 |
0 |
|
|
433031 |
135173168 |
1 |
NCl2O6C59H77 |
AB2C6D59E77 |
-110.99 |
2.66 |
-8.58 |
-0.68 |
0 |
|
|
433033 |
135173170 |
1 |
NCl2O6C58H77 |
AB2C6D58E77 |
-155.55 |
2.71 |
-8.46 |
-0.48 |
0 |
|
|
433034 |
135173171 |
1 |
O3C12H20 |
A3B12C20 |
-165.26 |
5.87 |
-11.02 |
-0.21 |
0 |
|
|
433035 |
135173172 |
1 |
NO4C14H19 |
AB4C14D19 |
-174.16 |
0.54 |
-8.59 |
0.06 |
0 |
|
|
433036 |
135173173 |
1 |
ON6C29H32 |
AB6C29D32 |
134.04 |
6.38 |
-8.17 |
-0.31 |
0 |
|
|
433037 |
135173174 |
1 |
ON6C29H34 |
AB6C29D34 |
57.94 |
4.46 |
-8.33 |
-0.43 |
0 |
|
|
433038 |
135173175 |
2 |
NC6H8 |
AB6C8 |
18.65 |
3.2 |
-8.71 |
0.66 |
0 |
|
|
433039 |
135173176 |
1 |
SN2O2C10H14 |
AB2C2D10E14 |
-61.61 |
7.69 |
-9.42 |
-0.35 |
0 |
|
|
433040 |
135173177 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-68.38 |
3.14 |
-9.31 |
-0.21 |
0 |
|
|
433041 |
135173178 |
1 |
NCl2O6C58H75 |
AB2C6D58E75 |
-151.59 |
2.92 |
-8.45 |
-0.46 |
0 |
|
|
433042 |
135173179 |
1 |
O3N4C24H30 |
A3B4C24D30 |
-66.74 |
1.52 |
-8.79 |
-0.56 |
0 |
|
|
433043 |
135173180 |
1 |
O4C19H34 |
A4B19C34 |
-241.44 |
2.41 |
-10.07 |
0.62 |
0 |
|
|
433044 |
135173181 |
2 |
O2C8H15 |
A2B8C15 |
-234.32 |
3.67 |
-10.42 |
0.64 |
0 |
|
|
433045 |
135173182 |
1 |
O4C17H30 |
A4B17C30 |
-220.17 |
2.42 |
-10.07 |
0.63 |
0 |
|
|
433046 |
135173183 |
1 |
OF3N3C14H14 |
AB3C3D14E14 |
-102.03 |
5.04 |
-8.96 |
-1.25 |
0 |
|
|
433047 |
135173184 |
1 |
ON3C28H35 |
AB3C28D35 |
108.47 |
4.0 |
-8.09 |
-0.05 |
0 |
|
|
433048 |
135173185 |
2 |
NC5H6 |
AB5C6 |
36.86 |
3.24 |
-9.22 |
0.43 |
0 |
|
|
433049 |
135173186 |
1 |
BrNH14C17 |
ABC14D17 |
72.74 |
3.42 |
-9.29 |
-0.7 |
0 |