List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
183090 |
76977435 |
1 |
NOC16H21 |
ABC16D21 |
-18.64 |
3.97 |
-9.19 |
-1.37 |
0 |
|
|
183091 |
76977436 |
1 |
BrNO2C14H16 |
ABC2D14E16 |
-30.46 |
4.18 |
-9.52 |
-1.77 |
0 |
|
|
183092 |
76977437 |
1 |
FON2H13C14 |
ABC2D13E14 |
-25.37 |
6.29 |
-9.68 |
-1.46 |
0 |
|
|
183093 |
76978108 |
1 |
O2N5C7H13 |
A2B5C7D13 |
37.02 |
7.86 |
-7.76 |
-1.17 |
0 |
|
|
183094 |
76978180 |
1 |
ON7H11C12 |
AB7C11D12 |
157.67 |
5.17 |
-8.29 |
-1.77 |
0 |
|
|
183095 |
76978705 |
1 |
N3O3H11C14 |
A3B3C11D14 |
-38.27 |
1.22 |
-9.36 |
-1.92 |
0 |
|
|
183096 |
76979335 |
1 |
ON5C14H19 |
AB5C14D19 |
57.03 |
7.47 |
-8.46 |
-0.12 |
0 |
|
|
183097 |
76979336 |
1 |
ON4C15H24 |
AB4C15D24 |
13.53 |
3.57 |
-8.09 |
0.18 |
0 |
|
|
183098 |
76979608 |
1 |
NO4C16H21 |
AB4C16D21 |
-132.29 |
8.7 |
-9.09 |
-0.89 |
0 |
|
|
183099 |
76979609 |
1 |
NO3C15H19 |
AB3C15D19 |
-92.91 |
5.27 |
-8.98 |
-0.63 |
0 |
|
|
183100 |
76979610 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-28.01 |
2.34 |
-8.68 |
-0.04 |
0 |
|
|
183101 |
76979648 |
1 |
SN2O2C10H20 |
AB2C2D10E20 |
-96.43 |
1.28 |
-8.76 |
0.63 |
0 |
|
|
183102 |
76979649 |
1 |
BrNO3C15H18 |
ABC3D15E18 |
-94.13 |
5.04 |
-8.92 |
-0.99 |
0 |
|
|
183103 |
76979650 |
1 |
FNO3C15H18 |
ABC3D15E18 |
-139.8 |
5.05 |
-8.77 |
-0.69 |
0 |
|
|
183104 |
76979808 |
2 |
ON2C5H10 |
AB2C5D10 |
-37.56 |
4.7 |
-8.87 |
0.8 |
0 |
|
|
183105 |
76979900 |
1 |
FO2N3C14H20 |
AB2C3D14E20 |
-86.47 |
4.42 |
-8.91 |
-0.09 |
0 |
|
|
183106 |
76979901 |
1 |
FO2N3C15H22 |
AB2C3D15E22 |
-92.06 |
2.54 |
-8.85 |
-0.21 |
0 |
|
|
183107 |
76979902 |
1 |
FO2N3C15H22 |
AB2C3D15E22 |
-92.26 |
2.51 |
-8.83 |
-0.23 |
0 |
|
|
183108 |
76979903 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-62.94 |
6.83 |
-9.21 |
-0.5 |
0 |
|
|
183109 |
76979904 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-99.2 |
3.54 |
-9.19 |
-0.24 |
0 |
|
|
183110 |
76979905 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-63.22 |
1.91 |
-9.15 |
-0.45 |
0 |
|
|
183111 |
76979906 |
1 |
O4N5C11H17 |
A4B5C11D17 |
-20.47 |
8.12 |
-9.24 |
-1.17 |
0 |
|
|
183112 |
76979918 |
1 |
O2N3C9H21 |
A2B3C9D21 |
-57.37 |
2.39 |
-8.64 |
0.86 |
0 |
|
|
183113 |
76980042 |
1 |
SO3N5C11H17 |
AB3C5D11E17 |
-46.39 |
4.02 |
-8.98 |
-0.43 |
0 |
|
|
183114 |
76980502 |
1 |
ClN4O4C12H13 |
AB4C4D12E13 |
-5.15 |
7.67 |
-8.32 |
-1.7 |
0 |
|
|
183115 |
76980503 |
1 |
OSN4C13H18 |
ABC4D13E18 |
52.42 |
7.2 |
-8.13 |
-0.31 |
0 |
|
|
183116 |
76980521 |
1 |
F2O2N3C12H13 |
A2B2C3D12E13 |
-86.77 |
5.08 |
-8.35 |
-0.7 |
2 |
|
|
183117 |
76980601 |
1 |
BrO2N3C13H14 |
AB2C3D13E14 |
-29.47 |
8.37 |
-8.78 |
-0.4 |
0 |
|
|
183118 |
76980914 |
1 |
N2O4C15H16 |
A2B4C15D16 |
-116.6 |
4.75 |
-9.72 |
-1.18 |
2 |
|
|
183119 |
76981035 |
1 |
SN2O4H12C13 |
AB2C4D12E13 |
-100.95 |
11.82 |
-8.99 |
-1.21 |
0 |
|
|
183120 |
76981436 |
1 |
ClN2O2C15H15 |
AB2C2D15E15 |
-10.85 |
3.73 |
-8.9 |
-0.34 |
0 |
|
|
183121 |
76981441 |
1 |
ClSN2O2H13C14 |
ABC2D2E13F14 |
3.78 |
3.67 |
-8.79 |
-0.81 |
0 |
|
|
183122 |
76981443 |
1 |
ClSN2O2C10H13 |
ABC2D2E10F13 |
-25.54 |
1.82 |
-9.1 |
-0.86 |
0 |
|
|
183123 |
76981444 |
1 |
ClOSN2C15H15 |
ABCD2E15F15 |
30.31 |
1.95 |
-8.81 |
-0.73 |
0 |
|
|
183124 |
76981486 |
1 |
ClN3O4H10C13 |
AB3C4D10E13 |
3.07 |
4.61 |
-9.34 |
-1.56 |
0 |
|
|
183125 |
76981487 |
1 |
ClN3O4H10C13 |
AB3C4D10E13 |
6.03 |
4.58 |
-9.3 |
-1.66 |
0 |
|
|
183126 |
76981702 |
1 |
ClON4C11H11 |
ABC4D11E11 |
46.63 |
2.72 |
-9.26 |
-1.02 |
0 |
|
|
183127 |
76981703 |
1 |
ClON4H11C14 |
ABC4D11E14 |
73.49 |
2.5 |
-9.1 |
-1.08 |
0 |
|
|
183128 |
76981704 |
1 |
ClN2O2C15H15 |
AB2C2D15E15 |
-5.75 |
3.26 |
-8.87 |
-0.32 |
0 |
|
|
183129 |
76981705 |
1 |
ClN2O2C12H17 |
AB2C2D12E17 |
-47.79 |
3.71 |
-8.85 |
-0.29 |
0 |
|
|
183130 |
76981927 |
1 |
N2O5C14H14 |
A2B5C14D14 |
-94.46 |
6.95 |
-9.9 |
-1.54 |
0 |
|
|
183131 |
76981928 |
1 |
NO3C9H13 |
AB3C9D13 |
-123.65 |
2.66 |
-9.52 |
0.05 |
0 |
|
|
183132 |
76981929 |
1 |
ClSN3O3H12C13 |
ABC3D3E12F13 |
-54.15 |
4.08 |
-9.0 |
-1.33 |
0 |
|
|
183133 |
76981930 |
1 |
BrNO4C15H16 |
ABC4D15E16 |
-128.15 |
4.1 |
-9.05 |
-0.85 |
0 |
|
|
183134 |
76981931 |
1 |
NO4C16H19 |
AB4C16D19 |
-135.75 |
4.73 |
-9.37 |
-0.66 |
0 |
|
|
183135 |
76982132 |
1 |
N3O3C12H23 |
A3B3C12D23 |
-121.87 |
2.75 |
-8.75 |
0.88 |
0 |
|
|
183136 |
76983309 |
1 |
ClNOC14H20 |
ABCD14E20 |
-25.46 |
3.79 |
-8.75 |
0.11 |
0 |
|
|
183137 |
76983310 |
1 |
OSN3C11H15 |
ABC3D11E15 |
-27.52 |
4.49 |
-8.64 |
-0.13 |
0 |
|
|
183138 |
76983311 |
1 |
BrClNO2C16H23 |
ABCD2E16F23 |
-71.33 |
4.97 |
-8.88 |
-0.31 |
0 |
|
|
183139 |
76983312 |
1 |
BrNO2C17H26 |
ABC2D17E26 |
-71.85 |
1.8 |
-8.76 |
-0.2 |
1 |