List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
372067 |
131292793 |
1 |
SN2O3C8H12 |
AB2C3D8E12 |
-143.13 |
7.21 |
-9.42 |
-0.1 |
0 |
|
|
372068 |
131292795 |
1 |
N3C13H13 |
A3B13C13 |
67.1 |
2.04 |
-9.34 |
-0.78 |
0 |
|
|
372069 |
131292796 |
1 |
N3C13H13 |
A3B13C13 |
68.92 |
3.08 |
-9.42 |
-0.86 |
0 |
|
|
372070 |
131292808 |
1 |
FON2C11H11 |
ABC2D11E11 |
-32.2 |
5.41 |
-9.4 |
-1.52 |
0 |
|
|
372071 |
131292816 |
1 |
ClN2O2C11H11 |
AB2C2D11E11 |
-59.83 |
3.35 |
-8.55 |
-0.57 |
0 |
|
|
372072 |
131292830 |
1 |
NSO3C11H13 |
ABC3D11E13 |
-88.16 |
7.5 |
-9.55 |
-0.78 |
0 |
|
|
372073 |
131292834 |
1 |
N2F3O3H5C7 |
A2B3C3D5E7 |
-169.11 |
4.07 |
-11.26 |
-2.27 |
0 |
|
|
372074 |
131292835 |
1 |
N2F3O3H5C7 |
A2B3C3D5E7 |
-167.32 |
2.73 |
-11.2 |
-2.3 |
0 |
|
|
372075 |
131292836 |
1 |
N2F3O3H5C7 |
A2B3C3D5E7 |
-169.07 |
2.94 |
-11.17 |
-2.22 |
0 |
|
|
372076 |
131292846 |
1 |
O2N3C10H15 |
A2B3C10D15 |
-65.16 |
2.89 |
-9.45 |
-0.58 |
0 |
|
|
372077 |
131292870 |
1 |
INO2C11H14 |
ABC2D11E14 |
-58.75 |
3.26 |
-9.32 |
-0.96 |
0 |
|
|
372078 |
131292916 |
1 |
BrN2C13H15 |
AB2C13D15 |
40.16 |
4.11 |
-8.67 |
-0.16 |
0 |
|
|
372079 |
131292920 |
1 |
ON4C11H14 |
AB4C11D14 |
25.81 |
7.04 |
-8.71 |
0.01 |
0 |
|
|
372080 |
131292974 |
1 |
NSO5C8H15 |
ABC5D8E15 |
-222.97 |
4.9 |
-9.87 |
0.24 |
0 |
|
|
372081 |
131293015 |
1 |
NOF3H4C7 |
ABC3D4E7 |
-140.49 |
3.53 |
-10.8 |
-1.54 |
0 |
|
|
372082 |
131293020 |
4 |
NC3H5 |
AB3C5 |
20.87 |
1.51 |
-8.31 |
0.3 |
0 |
|
|
372083 |
131293028 |
1 |
ClFN3H9C10 |
ABC3D9E10 |
5.27 |
4.08 |
-9.01 |
-0.63 |
0 |
|
|
372084 |
131293073 |
1 |
OSN2C7H10 |
ABC2D7E10 |
-6.67 |
2.06 |
-8.8 |
0.13 |
0 |
|
|
372085 |
131293086 |
1 |
NO5C10H11 |
AB5C10D11 |
-188.13 |
6.49 |
-10.07 |
-1.38 |
0 |
|
|
372086 |
131293104 |
1 |
SO3H8C9 |
AB3C8D9 |
-74.56 |
6.99 |
-9.39 |
-1.24 |
0 |
|
|
372087 |
131293105 |
1 |
ON3C12H17 |
AB3C12D17 |
-6.64 |
0.66 |
-9.69 |
-0.88 |
0 |
|
|
372088 |
131293107 |
1 |
SN2O2C8H8 |
AB2C2D8E8 |
-39.29 |
2.48 |
-8.11 |
-0.62 |
0 |
|
|
372089 |
131293110 |
1 |
ClSN2C10H15 |
ABC2D10E15 |
19.82 |
4.21 |
-8.76 |
-0.21 |
0 |
|
|
372090 |
131293115 |
2 |
N2C5H8 |
A2B5C8 |
45.75 |
3.36 |
-8.31 |
0.63 |
0 |
|
|
372091 |
131293119 |
2 |
N2C5H8 |
A2B5C8 |
46.62 |
4.84 |
-8.94 |
0.7 |
0 |
|
|
372092 |
131293120 |
1 |
ClOF2C11H11 |
ABC2D11E11 |
-144.29 |
5.45 |
-9.73 |
-0.7 |
0 |
|
|
372093 |
131293122 |
2 |
N2C5H7 |
A2B5C7 |
53.46 |
4.83 |
-8.12 |
0.65 |
0 |
|
|
372094 |
131293151 |
1 |
BrN2O2C11H11 |
AB2C2D11E11 |
-30.46 |
2.59 |
-8.42 |
-1.17 |
0 |
|
|
372095 |
131293160 |
3 |
NC3H3 |
AB3C3 |
78.31 |
5.19 |
-9.17 |
-0.97 |
0 |
|
|
372096 |
131293167 |
1 |
NSC12H13 |
ABC12D13 |
40.47 |
1.66 |
-8.48 |
0.04 |
0 |
|
|
372097 |
131293179 |
1 |
ClN3H10C11 |
AB3C10D11 |
42.61 |
0.43 |
-9.11 |
-0.77 |
0 |
|
|
372098 |
131293196 |
1 |
BrClOC8H8 |
ABCD8E8 |
-41.57 |
1.97 |
-9.17 |
-0.46 |
0 |
|
|
372099 |
131293206 |
1 |
FOBr2H7C9 |
ABC2D7E9 |
-61.67 |
2.24 |
-9.98 |
-1.04 |
0 |
|
|
372100 |
131293209 |
1 |
FOBr2H7C9 |
ABC2D7E9 |
-63.35 |
2.51 |
-9.77 |
-1.01 |
0 |
|
|
372101 |
131293226 |
1 |
H5N5C7 |
A5B5C7 |
101.13 |
4.53 |
-9.18 |
-1.06 |
0 |
|
|
372102 |
131293243 |
1 |
N2C11H12 |
A2B11C12 |
46.89 |
4.18 |
-9.23 |
-0.11 |
0 |
|
|
372103 |
131293264 |
1 |
OF2N2C11H12 |
AB2C2D11E12 |
-104.01 |
4.61 |
-8.39 |
-0.35 |
0 |
|
|
372104 |
131293268 |
1 |
FN2H11C12 |
AB2C11D12 |
14.56 |
2.53 |
-9.51 |
-0.39 |
0 |
|
|
372105 |
131293269 |
1 |
SN4H6C9 |
AB4C6D9 |
115.68 |
4.51 |
-9.17 |
-1.48 |
0 |
|
|
372106 |
131293271 |
1 |
FN2H11C12 |
AB2C11D12 |
13.91 |
3.13 |
-9.56 |
-0.34 |
0 |
|
|
372107 |
131293275 |
1 |
SN4H6C9 |
AB4C6D9 |
99.26 |
2.76 |
-8.98 |
-1.67 |
0 |
|
|
372108 |
131293278 |
2 |
ON2C5H5 |
AB2C5D5 |
67.73 |
6.4 |
-9.82 |
-0.96 |
0 |
|
|
372109 |
131293294 |
1 |
ON5C9H11 |
AB5C9D11 |
24.72 |
4.23 |
-8.85 |
-0.41 |
0 |
|
|
372110 |
131293296 |
1 |
ON5C9H11 |
AB5C9D11 |
24.58 |
6.78 |
-9.19 |
-0.45 |
0 |
|
|
372111 |
131293304 |
1 |
N5C11H15 |
A5B11C15 |
65.81 |
2.53 |
-9.0 |
-0.32 |
0 |
|
|
372112 |
131293307 |
1 |
FNOC12H12 |
ABCD12E12 |
-34.92 |
3.29 |
-9.22 |
-0.43 |
0 |
|
|
372113 |
131293329 |
1 |
O2N4C7H8 |
A2B4C7D8 |
65.69 |
1.02 |
-10.25 |
-1.17 |
0 |
|
|
372114 |
131293333 |
1 |
O2N4C7H8 |
A2B4C7D8 |
-3.85 |
5.73 |
-9.26 |
-0.45 |
0 |
|
|
372115 |
131293339 |
1 |
INOH3F5C7 |
ABCD3E5F7 |
-241.21 |
2.56 |
-10.14 |
-1.8 |
0 |
|
|
372116 |
131293346 |
1 |
INOH3F5C7 |
ABCD3E5F7 |
-239.62 |
1.67 |
-10.19 |
-1.8 |
0 |
|
|
372117 |
131293379 |
1 |
NO3C12H17 |
AB3C12D17 |
-125.36 |
3.27 |
-9.38 |
-0.17 |
0 |
|
|
372118 |
131293387 |
1 |
BrNO3C11H12 |
ABC3D11E12 |
-85.57 |
5.67 |
-9.76 |
-1.29 |
0 |
|
|
372119 |
131293399 |
1 |
SN2O2C11H16 |
AB2C2D11E16 |
-68.59 |
3.91 |
-8.16 |
-0.12 |
0 |
|
|
372120 |
131293402 |
1 |
ClF2O2C11H11 |
AB2C2D11E11 |
-178.81 |
2.04 |
-9.52 |
-0.71 |
0 |
|
|
372121 |
131293441 |
1 |
BrNOH8C9 |
ABCD8E9 |
-7.09 |
5.37 |
-9.5 |
-0.72 |
0 |
|
|
372122 |
131293468 |
1 |
BrFNO3C9H9 |
ABCD3E9F9 |
-149.17 |
2.96 |
-9.81 |
-0.89 |
0 |
|
|
372123 |
131293471 |
1 |
OBr2F3H5C8 |
AB2C3D5E8 |
-168.23 |
0.79 |
-9.9 |
-1.4 |
0 |
|
|
372124 |
131293473 |
1 |
BrO2F3H6C8 |
AB2C3D6E8 |
-211.69 |
2.17 |
-9.68 |
-0.98 |
0 |
|
|
372125 |
131293486 |
1 |
OBr2F3H5C8 |
AB2C3D5E8 |
-164.81 |
2.04 |
-9.87 |
-1.23 |
0 |
|
|
372126 |
131293490 |
1 |
OBr2F3H5C8 |
AB2C3D5E8 |
-167.19 |
2.26 |
-9.77 |
-1.29 |
0 |
|
|
372127 |
131293505 |
1 |
ON2F4C8H8 |
AB2C4D8E8 |
-208.14 |
2.05 |
-10.1 |
-1.08 |
0 |
|
|
372128 |
131293513 |
1 |
ClFNOC11H13 |
ABCDE11F13 |
-75.96 |
2.58 |
-9.45 |
-0.66 |
0 |
|
|
372129 |
131293521 |
1 |
BrNOF3C9H9 |
ABCD3E9F9 |
-185.53 |
4.11 |
-9.6 |
-1.19 |
0 |
|
|
372130 |
131293534 |
1 |
BrClINO2H4C7 |
ABCDE2F4G7 |
29.56 |
4.96 |
-9.99 |
-1.8 |
0 |
|
|
372131 |
131293535 |
1 |
ClN5C10H14 |
AB5C10D14 |
71.3 |
4.28 |
-9.79 |
-1.55 |
0 |
|
|
372132 |
131293545 |
1 |
SO4C11H12 |
AB4C11D12 |
-149.94 |
5.26 |
-8.29 |
-0.07 |
0 |
|
|
372133 |
131293550 |
1 |
SO4C11H12 |
AB4C11D12 |
-148.94 |
6.16 |
-8.61 |
-0.2 |
0 |
|
|
372134 |
131293568 |
1 |
N3O3C7H11 |
A3B3C7D11 |
-110.29 |
3.3 |
-8.63 |
-0.41 |
0 |
|
|
372135 |
131293569 |
1 |
ON3H7C10 |
AB3C7D10 |
68.26 |
2.79 |
-9.32 |
-1.58 |
0 |
|
|
372136 |
131293637 |
1 |
BrClOSF2H6C10 |
ABCDE2F6G10 |
-116.54 |
2.65 |
-8.85 |
-1.31 |
0 |
|
|
372137 |
131293646 |
1 |
BrClOSF2H6C10 |
ABCDE2F6G10 |
-117.99 |
1.63 |
-8.95 |
-1.27 |
0 |
|
|
372138 |
131293648 |
1 |
BrClOSF2H6C10 |
ABCDE2F6G10 |
-114.02 |
0.62 |
-8.78 |
-1.28 |
0 |
|
|
372139 |
131293692 |
1 |
ON3C11H19 |
AB3C11D19 |
-34.27 |
4.32 |
-9.66 |
-0.88 |
0 |
|
|
372140 |
131293716 |
1 |
OSN3C9H15 |
ABC3D9E15 |
-11.04 |
5.72 |
-9.32 |
-0.32 |
0 |
|
|
372141 |
131293725 |
1 |
ION2C7H9 |
ABC2D7E9 |
-1.59 |
1.75 |
-8.2 |
-0.76 |
0 |