List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
218177 |
85088995 |
1 |
OSN4C25H32 |
ABC4D25E32 |
-8.47 |
4.16 |
-8.12 |
-0.69 |
0 |
|
|
218178 |
85088996 |
1 |
O5C26H44 |
A5B26C44 |
-262.56 |
3.42 |
-8.7 |
0.31 |
0 |
|
|
218179 |
85088997 |
1 |
O3C29H40 |
A3B29C40 |
-131.41 |
4.36 |
-8.51 |
-0.17 |
0 |
|
|
218180 |
85088998 |
1 |
O3C29H40 |
A3B29C40 |
-132.23 |
2.68 |
-9.27 |
-0.23 |
0 |
|
|
218181 |
85088999 |
2 |
OC15H22 |
AB15C22 |
21.24 |
1.81 |
-9.72 |
1.1 |
0 |
|
|
218182 |
85089000 |
1 |
BrClNSO3H11C18 |
ABCDE3F11G18 |
-48.84 |
4.27 |
-9.57 |
-1.25 |
0 |
|
|
218183 |
85089001 |
1 |
ClOF3N4H18C21 |
ABC3D4E18F21 |
-96.19 |
1.63 |
-9.09 |
-1.96 |
0 |
|
|
218184 |
85089002 |
1 |
ClFON2C26H26 |
ABCD2E26F26 |
-26.82 |
3.66 |
-8.84 |
-0.62 |
0 |
|
|
218185 |
85089003 |
1 |
ClN2O2C26H29 |
AB2C2D26E29 |
-31.85 |
4.91 |
-9.12 |
-0.46 |
0 |
|
|
218186 |
85089004 |
1 |
ON7C25H27 |
AB7C25D27 |
48.95 |
7.04 |
-8.2 |
-0.51 |
0 |
|
|
218187 |
85089005 |
1 |
SO3N5C22H23 |
AB3C5D22E23 |
0.81 |
7.68 |
-8.29 |
-0.66 |
0 |
|
|
218188 |
85089006 |
1 |
NO7C23H35 |
AB7C23D35 |
-343.99 |
2.9 |
-9.73 |
-0.2 |
0 |
|
|
218189 |
85089007 |
1 |
O2N3C28H29 |
A2B3C28D29 |
3.57 |
5.79 |
-9.33 |
-0.03 |
0 |
|
|
218190 |
85089011 |
1 |
SN3O5C21H31 |
AB3C5D21E31 |
-207.74 |
8.12 |
-8.85 |
-0.86 |
0 |
|
|
218191 |
85089012 |
1 |
SiO4N5C20H35 |
AB4C5D20E35 |
-149.62 |
5.66 |
-8.67 |
-0.42 |
0 |
|
|
218192 |
85089013 |
1 |
NO2C29H43 |
AB2C29D43 |
-133.83 |
2.87 |
-7.66 |
0.86 |
0 |
|
|
218193 |
85089014 |
2 |
NOCl2C9H10 |
ABC2D9E10 |
-72.79 |
3.21 |
-8.83 |
-0.54 |
0 |
|
|
218194 |
85089015 |
1 |
P2O7C19H36 |
A2B7C19D36 |
-467.43 |
5.09 |
-9.09 |
0.09 |
0 |
|
|
218195 |
85089016 |
1 |
ON2F3H25C26 |
AB2C3D25E26 |
-107.85 |
1.93 |
-8.82 |
-0.61 |
0 |
|
|
218196 |
85089017 |
2 |
O3C13H15 |
A3B13C15 |
-192.82 |
4.96 |
-9.65 |
-0.19 |
0 |
|
|
218197 |
85089018 |
2 |
N2O2C12H17 |
A2B2C12D17 |
-160.39 |
5.18 |
-8.74 |
-0.27 |
0 |
|
|
218198 |
85089019 |
1 |
SN2O2C26H34 |
AB2C2D26E34 |
-56.82 |
7.84 |
-8.39 |
-0.69 |
0 |
|
|
218199 |
85089020 |
1 |
O5C26H46 |
A5B26C46 |
-287.13 |
3.53 |
-9.49 |
1.05 |
0 |
|
|
218200 |
85089021 |
1 |
O3C29H42 |
A3B29C42 |
-158.4 |
3.58 |
-9.33 |
0.41 |
0 |
|
|
218201 |
85089022 |
1 |
O3S4C19H34 |
A3B4C19D34 |
-129.75 |
3.59 |
-9.04 |
-0.73 |
0 |
|
|
218202 |
85089023 |
1 |
ClF3O5C20H26 |
AB3C5D20E26 |
-383.03 |
4.31 |
-9.9 |
-0.3 |
0 |
|
|
218203 |
85089024 |
1 |
ClFN2O5C21H24 |
ABC2D5E21F24 |
-256.55 |
4.06 |
-9.0 |
-0.93 |
0 |
|
|
218204 |
85089025 |
1 |
ClN2O3C25H27 |
AB2C3D25E27 |
-103.73 |
4.1 |
-9.15 |
-0.76 |
0 |
|
|
218205 |
85089026 |
1 |
BrSN2O5C17H17 |
ABC2D5E17F17 |
-168.76 |
3.29 |
-9.06 |
-0.88 |
0 |
|
|
218206 |
85089027 |
1 |
FSeO4C21H24 |
ABC4D21E24 |
-163.93 |
6.08 |
0.0 |
0.0 |
0 |
|
|
218207 |
85089028 |
1 |
FSN5O6C17H18 |
ABC5D6E17F18 |
-199.72 |
6.32 |
-9.35 |
-0.83 |
0 |
|
|
218208 |
85089029 |
1 |
F2N3O7C18H31 |
A2B3C7D18E31 |
-457.52 |
6.93 |
-10.13 |
-0.2 |
0 |
|
|
218209 |
85089030 |
1 |
NO7C24H25 |
AB7C24D25 |
-233.08 |
0.88 |
-9.98 |
-0.47 |
0 |
|
|
218210 |
85089031 |
1 |
S2N3O7C17H17 |
A2B3C7D17E17 |
-202.52 |
8.89 |
-10.24 |
-1.76 |
0 |
|
|
218211 |
85089033 |
1 |
S2N3O6C18H21 |
A2B3C6D18E21 |
-198.79 |
1.75 |
-9.47 |
-1.0 |
0 |
|
|
218212 |
85089034 |
1 |
S2N5O5C17H21 |
A2B5C5D17E21 |
-105.43 |
6.51 |
-9.32 |
-0.96 |
0 |
|
|
218213 |
85089035 |
1 |
O2F3N3C23H32 |
A2B3C3D23E32 |
-241.71 |
4.28 |
-8.75 |
-0.79 |
0 |
|
|
218214 |
85089036 |
1 |
SN3O4C23H25 |
AB3C4D23E25 |
-107.09 |
7.13 |
-9.52 |
-0.74 |
0 |
|
|
218215 |
85089037 |
1 |
NO5C26H33 |
AB5C26D33 |
-187.54 |
3.87 |
-9.32 |
0.14 |
0 |
|
|
218216 |
85089038 |
1 |
O2N3C28H35 |
A2B3C28D35 |
-69.02 |
5.36 |
-8.6 |
0.25 |
0 |
|
|
218217 |
85089039 |
1 |
N7C26H33 |
A7B26C33 |
109.75 |
3.54 |
-8.33 |
-0.64 |
0 |
|
|
218218 |
85089040 |
1 |
SN3O3C24H29 |
AB3C3D24E29 |
-73.11 |
2.58 |
-9.64 |
-1.01 |
0 |
|
|
218219 |
85089041 |
1 |
NO4C27H37 |
AB4C27D37 |
-186.65 |
3.98 |
-8.99 |
-0.33 |
0 |
|
|
218220 |
85089045 |
1 |
FIN2O3H14C17 |
ABC2D3E14F17 |
-82.16 |
6.08 |
-9.61 |
-1.33 |
0 |
|
|
218221 |
85089046 |
1 |
N2O9H16C21 |
A2B9C16D21 |
-169.53 |
3.99 |
-9.38 |
-2.33 |
0 |
|
|
218222 |
85089050 |
2 |
N2O3C11H12 |
A2B3C11D12 |
-150.17 |
1.35 |
-9.24 |
-1.74 |
0 |
|
|
218223 |
85089051 |
1 |
SN4O7C18H24 |
AB4C7D18E24 |
-227.09 |
2.71 |
-9.05 |
-1.61 |
0 |
|
|
218224 |
85089052 |
1 |
N4O5C23H28 |
A4B5C23D28 |
-186.4 |
3.87 |
-9.03 |
-0.22 |
0 |
|
|
218225 |
85089055 |
4 |
NOC6H8 |
ABC6D8 |
-140.3 |
6.02 |
-9.27 |
-0.43 |
0 |
|
|
218226 |
85089056 |
1 |
SF2N2O5C19H34 |
AB2C2D5E19F34 |
-369.49 |
3.09 |
-9.12 |
-0.12 |
0 |