List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
318942 |
126653788 |
2 |
O3F6C8H8 |
A3B6C8D8 |
-895.38 |
5.33 |
-11.57 |
-1.25 |
0 |
|
|
318943 |
126653791 |
1 |
BrN2F3O3C16H18 |
AB2C3D3E16F18 |
-269.46 |
4.62 |
-9.34 |
-0.81 |
0 |
|
|
318944 |
126653792 |
1 |
ClFN2O3C16H20 |
ABC2D3E16F20 |
-198.34 |
5.95 |
-9.0 |
-0.27 |
0 |
|
|
318946 |
126653795 |
1 |
F2N2O3C15H24 |
A2B2C3D15E24 |
-266.04 |
2.69 |
-9.53 |
0.28 |
0 |
|
|
318947 |
126653798 |
1 |
ClFN2O3C19H24 |
ABC2D3E19F24 |
-181.2 |
3.17 |
-9.39 |
-0.07 |
0 |
|
|
318949 |
126653835 |
1 |
BrOF2N3C12H14 |
ABC2D3E12F14 |
-125.26 |
1.95 |
-9.32 |
-0.62 |
0 |
|
|
318950 |
126653840 |
1 |
NO4C18H23 |
AB4C18D23 |
-150.5 |
1.13 |
-9.58 |
0.08 |
0 |
|
|
318952 |
126653846 |
1 |
BrO4N6C31H33 |
AB4C6D31E33 |
-82.57 |
5.79 |
-8.94 |
-0.8 |
0 |
|
|
318953 |
126653864 |
1 |
O3N4H14C19 |
A3B4C14D19 |
-21.31 |
2.05 |
-9.3 |
-1.09 |
0 |
|
|
318954 |
126653865 |
1 |
N3O3H23C24 |
A3B3C23D24 |
-61.35 |
7.15 |
-8.72 |
-0.62 |
0 |
|
|
318955 |
126653867 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-90.82 |
6.15 |
-8.62 |
-0.46 |
0 |
|
|
318956 |
126653868 |
1 |
O3N6C32H32 |
A3B6C32D32 |
-25.83 |
12.15 |
-8.41 |
-0.64 |
0 |
|
|
318959 |
126653875 |
1 |
SO2N7C29H29 |
AB2C7D29E29 |
56.13 |
4.8 |
-8.12 |
-0.38 |
0 |
|
|
318960 |
126653938 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-34.26 |
4.71 |
-8.92 |
-1.02 |
0 |
|
|
318962 |
126653948 |
1 |
SCl2N4O4C36H36 |
AB2C4D4E36F36 |
-50.15 |
8.21 |
-8.27 |
-1.16 |
0 |
|
|
318963 |
126653951 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-51.64 |
2.82 |
-9.0 |
-0.94 |
0 |
|
|
318964 |
126653957 |
1 |
F2C21H28 |
A2B21C28 |
-91.71 |
3.13 |
-9.25 |
-0.29 |
0 |
|
|
318965 |
126653959 |
1 |
N4O5C22H24 |
A4B5C22D24 |
-135.56 |
4.07 |
-9.2 |
-0.99 |
0 |
|
|
318966 |
126653960 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-46.22 |
4.2 |
-8.71 |
-0.97 |
0 |
|
|
318968 |
126653972 |
1 |
BrFO3N4C19H28 |
ABC3D4E19F28 |
-189.25 |
1.69 |
-8.98 |
-0.64 |
0 |
|
|
318969 |
126653977 |
1 |
O3F4N4C15H20 |
A3B4C4D15E20 |
-316.43 |
3.73 |
-9.07 |
-0.03 |
0 |
|
|
318970 |
126653986 |
1 |
FO3N4C15H23 |
AB3C4D15E23 |
-168.86 |
3.4 |
-8.57 |
0.27 |
0 |
|
|
318971 |
126653996 |
1 |
BrFSN3O3C14H19 |
ABCD3E3F14G19 |
-179.76 |
4.72 |
-9.11 |
-0.82 |
0 |
|
|
318973 |
126654014 |
1 |
BrO3N7H30C31 |
AB3C7D30E31 |
30.87 |
3.28 |
-9.22 |
-1.13 |
0 |
|
|
318977 |
126654027 |
1 |
ClFO2C12H12 |
ABC2D12E12 |
-116.3 |
1.55 |
-9.64 |
-0.45 |
0 |
|
|
318979 |
126654035 |
1 |
ON4H14C15 |
AB4C14D15 |
51.76 |
5.97 |
-8.99 |
-0.88 |
0 |
|
|
318980 |
126654041 |
1 |
ClF3O3N6H34C38 |
AB3C3D6E34F38 |
-137.04 |
11.48 |
-8.08 |
-0.74 |
0 |
|
|
318981 |
126654042 |
1 |
FO3N6H31C35 |
AB3C6D31E35 |
-19.57 |
10.36 |
-8.84 |
-0.91 |
0 |
|
|
318982 |
126654049 |
1 |
BrO3N8H23C26 |
AB3C8D23E26 |
26.46 |
3.09 |
-9.32 |
-1.15 |
0 |
|
|
318985 |
126654055 |
1 |
F4O4N7H23C30 |
A4B4C7D23E30 |
-173.13 |
8.44 |
-9.08 |
-1.14 |
0 |
|
|
318986 |
126654056 |
1 |
BrO3N8H23C28 |
AB3C8D23E28 |
75.96 |
7.45 |
-9.31 |
-1.08 |
0 |
|
|
318987 |
126654060 |
1 |
BrFO3N9H21C24 |
ABC3D9E21F24 |
-36.85 |
9.25 |
-9.11 |
-1.2 |
0 |
|
|
318988 |
126654065 |
1 |
BrFO3N9H23C27 |
ABC3D9E23F27 |
-8.32 |
5.58 |
-9.0 |
-1.06 |
0 |
|
|
318989 |
126654070 |
1 |
BrFO3N7H27C28 |
ABC3D7E27F28 |
-67.71 |
4.48 |
-8.59 |
-0.95 |
0 |
|
|
318991 |
126654074 |
2 |
ClN2H16C17 |
AB2C16D17 |
112.75 |
6.02 |
-8.67 |
-0.48 |
0 |
|
|
318992 |
126654087 |
2 |
ON3C12H18 |
AB3C12D18 |
-41.11 |
1.59 |
-8.56 |
-0.26 |
0 |
|
|
318994 |
126654089 |
1 |
O2N7C21H31 |
A2B7C21D31 |
-3.66 |
5.96 |
-8.54 |
-0.18 |
0 |
|
|
318995 |
126654091 |
1 |
FO3N7H28C30 |
AB3C7D28E30 |
-17.5 |
4.99 |
-8.97 |
-1.0 |
0 |
|
|
318997 |
126654096 |
1 |
O3N7C31H33 |
A3B7C31D33 |
-32.73 |
1.88 |
-8.28 |
-0.47 |
0 |
|
|
318999 |
126654099 |
1 |
ClFO3N5C24H27 |
ABC3D5E24F27 |
-107.48 |
3.58 |
-9.43 |
-0.65 |
0 |
|
|
319001 |
126654101 |
1 |
ClFO3N5C25H29 |
ABC3D5E25F29 |
-106.24 |
4.24 |
-9.48 |
-0.67 |
0 |
|
|
319002 |
126654102 |
1 |
N2O3C9H20 |
A2B3C9D20 |
-132.3 |
4.84 |
-8.92 |
0.93 |
0 |
|
|
319003 |
126654103 |
4 |
NC2H2 |
AB2C2 |
99.19 |
2.63 |
-9.15 |
-0.55 |
0 |
|
|
319004 |
126654104 |
1 |
O2N5C10H11 |
A2B5C10D11 |
19.13 |
2.83 |
-9.07 |
-1.17 |
0 |
|
|
319005 |
126654105 |
1 |
N2O8C15H22 |
A2B8C15D22 |
-334.87 |
5.77 |
-9.94 |
-1.71 |
0 |
|
|
319006 |
126654107 |
1 |
O2N3C6H11 |
A2B3C6D11 |
-31.09 |
2.41 |
-10.02 |
-0.18 |
0 |
|
|
319007 |
126654108 |
2 |
ON6C11H26 |
AB6C11D26 |
-113.91 |
3.82 |
-8.28 |
1.08 |
0 |
|
|
319008 |
126654109 |
1 |
F2O3N4C24H28 |
A2B3C4D24E28 |
-32.23 |
3.8 |
-9.72 |
-1.35 |
0 |
|
|
319009 |
126654110 |
1 |
NO5C40H57 |
AB5C40D57 |
-153.52 |
4.75 |
-7.99 |
-0.58 |
0 |
|
|
319011 |
126654118 |
1 |
NOC10H19 |
ABC10D19 |
-32.56 |
3.23 |
-9.55 |
1.08 |
0 |
|
|
319012 |
126654120 |
1 |
SN2O2C24H26 |
AB2C2D24E26 |
5.18 |
3.07 |
-8.34 |
-0.89 |
0 |
|
|
319013 |
126654148 |
1 |
F3N5O5H16C24 |
A3B5C5D16E24 |
-145.55 |
8.46 |
-9.17 |
-1.43 |
0 |
|
|
319015 |
126654153 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-31.09 |
2.97 |
-8.74 |
-0.46 |
0 |
|
|
319017 |
126654157 |
2 |
ON3C9H12 |
AB3C9D12 |
-15.32 |
1.73 |
-8.86 |
-0.72 |
0 |
|
|
319019 |
126654161 |
3 |
ON2C6H8 |
AB2C6D8 |
-52.55 |
1.31 |
-8.85 |
-0.75 |
0 |
|
|
319020 |
126654163 |
1 |
O3N5C14H17 |
A3B5C14D17 |
-57.21 |
2.75 |
-8.65 |
-0.68 |
0 |
|
|
319021 |
126654171 |
1 |
O2N7C36H45 |
A2B7C36D45 |
10.02 |
2.15 |
-8.41 |
-0.63 |
0 |
|
|
319022 |
126654177 |
1 |
FO2N3H8C11 |
AB2C3D8E11 |
-64.97 |
3.83 |
-9.57 |
-1.26 |
0 |
|
|
319023 |
126654184 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-39.58 |
2.93 |
-8.67 |
-0.52 |
0 |
|
|
319024 |
126654193 |
1 |
O2N5C38H45 |
A2B5C38D45 |
-12.72 |
1.98 |
-8.29 |
-0.54 |
0 |
|
|
319025 |
126654199 |
1 |
O2N4C27H32 |
A2B4C27D32 |
-32.39 |
3.97 |
-8.87 |
-0.58 |
0 |
|
|
319026 |
126654201 |
1 |
NO3C13H23 |
AB3C13D23 |
-142.98 |
2.52 |
-9.21 |
0.51 |
0 |
|
|
319027 |
126654202 |
1 |
N4O5C32H40 |
A4B5C32D40 |
-179.49 |
3.41 |
-8.79 |
-0.58 |
0 |
|
|
319028 |
126654221 |
1 |
NSO4C7H15 |
ABC4D7E15 |
-174.45 |
5.59 |
-9.82 |
0.5 |
0 |
|
|
319030 |
126654249 |
1 |
N4O5C33H40 |
A4B5C33D40 |
-145.48 |
7.85 |
-8.9 |
-0.89 |
0 |
|
|
319031 |
126654257 |
1 |
OSN4C25H30 |
ABC4D25E30 |
29.2 |
7.05 |
-9.32 |
-1.11 |
0 |
|
|
319033 |
126654263 |
1 |
ClN2O2H23C24 |
AB2C2D23E24 |
13.64 |
1.39 |
-9.32 |
-0.71 |
0 |
|
|
319034 |
126654264 |
1 |
FON4C23H23 |
ABC4D23E23 |
9.96 |
4.88 |
-9.72 |
-1.06 |
0 |
|
|
319035 |
126654279 |
1 |
ClO2N3C24H26 |
AB2C3D24E26 |
0.44 |
6.01 |
-8.7 |
-0.34 |
0 |
|
|
319037 |
126654282 |
1 |
BrOC9H15 |
ABC9D15 |
-35.23 |
1.51 |
-9.34 |
-0.11 |
0 |
|
|
319038 |
126654284 |
1 |
ClO2N5C29H30 |
AB2C5D29E30 |
36.62 |
8.54 |
-8.91 |
-0.88 |
0 |
|
|
319039 |
126654285 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-65.16 |
4.08 |
-8.15 |
-0.88 |
0 |
|
|
319040 |
126654286 |
1 |
O5C32H64 |
A5B32C64 |
-377.91 |
2.95 |
-10.25 |
0.81 |
0 |
|
|
319043 |
126654296 |
1 |
NO3C17H37 |
AB3C17D37 |
-185.58 |
3.14 |
-8.83 |
1.48 |
0 |
|
|
319044 |
126654300 |
1 |
N3C16H23 |
A3B16C23 |
35.75 |
2.55 |
-8.51 |
0.3 |
0 |