List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
27123 |
814458 |
1 |
N3O3C11H17 |
A3B3C11D17 |
-81.17 |
6.22 |
-9.46 |
0.02 |
0 |
|
|
27124 |
814487 |
1 |
N3O4C15H17 |
A3B4C15D17 |
-77.23 |
3.88 |
-9.4 |
-0.51 |
0 |
|
|
27125 |
814750 |
1 |
ION2H9C12 |
ABC2D9E12 |
34.67 |
5.27 |
-9.69 |
-1.31 |
0 |
|
|
27126 |
814752 |
1 |
ON2C21H22 |
AB2C21D22 |
28.89 |
6.12 |
-8.29 |
0.04 |
0 |
|
|
27127 |
814753 |
1 |
OSN2C20H22 |
ABC2D20E22 |
13.72 |
4.15 |
-8.14 |
0.15 |
0 |
|
|
27128 |
814754 |
1 |
OSN2C20H22 |
ABC2D20E22 |
14.07 |
5.94 |
-8.22 |
0.14 |
0 |
|
|
27129 |
814755 |
1 |
ION2H9C12 |
ABC2D9E12 |
35.09 |
6.05 |
-9.56 |
-1.4 |
0 |
|
|
27130 |
815017 |
1 |
N2O3H18C19 |
A2B3C18D19 |
-81.86 |
6.35 |
-9.29 |
-1.67 |
0 |
|
|
27131 |
815111 |
1 |
NOC15H23 |
ABC15D23 |
-46.74 |
1.87 |
-8.62 |
0.38 |
0 |
|
|
27132 |
815154 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-127.93 |
5.08 |
-9.04 |
0.48 |
0 |
|
|
27133 |
815281 |
1 |
NOSF3H14C17 |
ABCD3E14F17 |
-150.11 |
7.01 |
-9.2 |
-0.75 |
0 |
|
|
27134 |
815283 |
1 |
NOSF3C14H16 |
ABCD3E14F16 |
-195.2 |
6.58 |
-9.23 |
-0.63 |
0 |
|
|
27135 |
815284 |
1 |
N2O3C15H16 |
A2B3C15D16 |
-77.22 |
3.8 |
-9.32 |
-0.52 |
0 |
|
|
27136 |
815296 |
1 |
NSO2F3H12C15 |
ABC2D3E12F15 |
-178.1 |
6.61 |
-9.25 |
-0.79 |
0 |
|
|
27137 |
815303 |
1 |
NOSF3C16H18 |
ABCD3E16F18 |
-194.34 |
6.48 |
-9.18 |
-0.71 |
0 |
|
|
27138 |
815317 |
1 |
FN2O2H15C17 |
AB2C2D15E17 |
-60.56 |
3.93 |
-9.45 |
-0.55 |
0 |
|
|
27139 |
815321 |
1 |
OSN2C17H26 |
ABC2D17E26 |
-49.22 |
5.77 |
-9.09 |
-0.34 |
0 |
|
|
27140 |
815326 |
1 |
ClSN2O2H15C16 |
ABC2D2E15F16 |
-23.3 |
4.62 |
-9.26 |
-0.56 |
0 |
|
|
27141 |
815412 |
1 |
NOS2C11H15 |
ABC2D11E15 |
-25.66 |
4.97 |
-8.94 |
-0.38 |
0 |
|
|
27142 |
815565 |
1 |
NOSC16H23 |
ABCD16E23 |
-51.53 |
3.08 |
-8.88 |
-0.2 |
0 |
|
|
27143 |
815578 |
1 |
NOSC21H25 |
ABCD21E25 |
-22.84 |
3.64 |
-8.86 |
-0.14 |
0 |
|
|
27144 |
815630 |
1 |
OSN2H16C17 |
ABC2D16E17 |
17.62 |
6.17 |
-8.91 |
-0.74 |
0 |
|
|
27145 |
815631 |
1 |
OSN2C18H22 |
ABC2D18E22 |
-6.31 |
3.06 |
-8.55 |
0.1 |
0 |
|
|
27146 |
815632 |
1 |
OSN2C18H22 |
ABC2D18E22 |
-3.49 |
2.0 |
-8.52 |
0.04 |
0 |
|
|
27147 |
815726 |
1 |
NS2O3H13C15 |
AB2C3D13E15 |
-45.52 |
4.65 |
-8.68 |
-0.89 |
0 |
|
|
27148 |
815871 |
1 |
SN2O2C17H18 |
AB2C2D17E18 |
-39.52 |
3.97 |
-8.66 |
-0.85 |
0 |
|
|
27149 |
816069 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-112.27 |
9.58 |
-8.84 |
-0.23 |
0 |
|
|
27150 |
816650 |
1 |
NO3C11H15 |
AB3C11D15 |
-125.62 |
2.68 |
-9.1 |
0.28 |
0 |
|
|
27151 |
816662 |
2 |
ON2C8H12 |
AB2C8D12 |
-70.94 |
3.54 |
-9.65 |
-1.2 |
0 |
|
|
27152 |
816671 |
1 |
N2O2H12C13 |
A2B2C12D13 |
-17.14 |
5.26 |
-8.87 |
-0.63 |
0 |
|
|
27153 |
816741 |
2 |
OC6H7 |
AB6C7 |
-55.99 |
2.34 |
-9.58 |
0.18 |
0 |
|
|
27154 |
816742 |
2 |
OC6H7 |
AB6C7 |
-57.5 |
1.55 |
-9.59 |
0.18 |
0 |
|
|
27155 |
816746 |
1 |
NOH13C14 |
ABC13D14 |
10.14 |
2.62 |
-9.33 |
-0.75 |
0 |
|
|
27156 |
816757 |
1 |
NSO2C10H11 |
ABC2D10E11 |
-33.06 |
8.91 |
-10.48 |
-0.87 |
0 |
|
|
27157 |
816758 |
1 |
NSO2C10H11 |
ABC2D10E11 |
-54.2 |
5.95 |
-9.22 |
-1.1 |
0 |
|
|
27158 |
816937 |
1 |
NO4C18H19 |
AB4C18D19 |
-123.35 |
1.81 |
-8.39 |
-0.07 |
0 |
|
|
27159 |
816938 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-136.82 |
5.77 |
-8.6 |
-0.14 |
0 |
|
|
27160 |
816961 |
1 |
SO2N3C15H17 |
AB2C3D15E17 |
-57.84 |
6.12 |
-8.96 |
-0.8 |
0 |
|
|
27161 |
816964 |
1 |
OSN3C10H11 |
ABC3D10E11 |
-11.19 |
4.23 |
-8.45 |
-0.42 |
0 |
|
|
27162 |
817186 |
1 |
SN3O4H15C16 |
AB3C4D15E16 |
-62.66 |
5.25 |
-9.4 |
-1.44 |
0 |
|
|
27163 |
817207 |
1 |
O2F3N3C15H18 |
A2B3C3D15E18 |
-201.31 |
6.69 |
-8.52 |
-0.42 |
0 |
|
|
27164 |
817471 |
1 |
ON4C10H12 |
AB4C10D12 |
6.67 |
9.54 |
-8.61 |
-0.36 |
0 |
|
|
27165 |
817829 |
1 |
NO2C13H15 |
AB2C13D15 |
-64.65 |
5.47 |
-8.69 |
-0.35 |
0 |
|
|
27166 |
817948 |
1 |
ON2H8C12 |
AB2C8D12 |
34.54 |
1.97 |
-9.14 |
-1.4 |
0 |
|
|
27167 |
817998 |
1 |
ClFN2O2C16H16 |
ABC2D2E16F16 |
-101.78 |
7.25 |
-8.35 |
-0.92 |
0 |
|
|
27168 |
818436 |
1 |
N2O4C11H16 |
A2B4C11D16 |
-97.57 |
5.75 |
-10.51 |
0.35 |
0 |
|
|
27169 |
818437 |
1 |
O3C10H14 |
A3B10C14 |
-100.79 |
3.82 |
-10.29 |
0.67 |
0 |
|
|
27170 |
818511 |
1 |
NO4C15H19 |
AB4C15D19 |
-177.99 |
5.9 |
-8.92 |
-0.24 |
0 |
|
|
27171 |
818580 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-17.44 |
5.46 |
-9.2 |
0.09 |
0 |
|
|
27172 |
818581 |
2 |
NOC10H12 |
ABC10D12 |
-39.69 |
2.22 |
-9.2 |
-0.12 |
0 |