List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
36100 |
7980764 |
1 |
NO4H21C23 |
AB4C21D23 |
-107.62 |
4.75 |
-9.29 |
-1.07 |
0 |
|
|
36101 |
7980765 |
1 |
NO4H21C23 |
AB4C21D23 |
-108.69 |
4.16 |
-9.43 |
-1.23 |
0 |
|
|
36102 |
7980766 |
2 |
NO2C12H12 |
AB2C12D12 |
-113.27 |
10.01 |
-9.11 |
-1.37 |
0 |
|
|
36103 |
7980768 |
1 |
NO5C24H25 |
AB5C24D25 |
-166.62 |
4.48 |
-8.89 |
-0.73 |
0 |
|
|
36104 |
7980769 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-159.7 |
3.81 |
-9.44 |
-1.28 |
0 |
|
|
36105 |
7980770 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-158.69 |
2.42 |
-9.43 |
-1.23 |
0 |
|
|
36106 |
7980771 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-159.3 |
2.6 |
-9.42 |
-1.22 |
0 |
|
|
36107 |
7980772 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-158.62 |
4.56 |
-9.44 |
-1.27 |
0 |
|
|
36108 |
7980773 |
1 |
ClN2O5H13C19 |
AB2C5D13E19 |
-65.34 |
8.23 |
-9.57 |
-1.43 |
0 |
|
|
36109 |
7980774 |
1 |
NO3F5H10C19 |
AB3C5D10E19 |
-272.48 |
6.39 |
-9.54 |
-1.4 |
0 |
|
|
36110 |
7980775 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-136.09 |
2.88 |
-9.12 |
-0.83 |
0 |
|
|
36111 |
7980776 |
1 |
N2O5H18C21 |
A2B5C18D21 |
-87.12 |
2.74 |
-9.18 |
-1.41 |
0 |
|
|
36112 |
7980777 |
1 |
NO3C19H21 |
AB3C19D21 |
-100.0 |
2.47 |
-9.12 |
-0.87 |
0 |
|
|
36113 |
7980778 |
1 |
NO3C19H21 |
AB3C19D21 |
-98.41 |
3.3 |
-9.12 |
-0.86 |
0 |
|
|
36114 |
7980779 |
1 |
FO3H13C19 |
AB3C13D19 |
-93.32 |
1.58 |
-9.2 |
-0.96 |
0 |
|
|
36115 |
7980780 |
1 |
N2O5H14C19 |
A2B5C14D19 |
-64.52 |
2.95 |
-9.35 |
-1.46 |
0 |
|
|
36116 |
7980783 |
1 |
ClNO3H18C21 |
ABC3D18E21 |
-78.29 |
6.44 |
-9.48 |
-1.3 |
0 |
|
|
36117 |
7980784 |
1 |
NO5H19C22 |
AB5C19D22 |
-132.94 |
4.01 |
-8.83 |
-1.14 |
0 |
|
|
36118 |
7980785 |
1 |
NO5H19C22 |
AB5C19D22 |
-132.81 |
4.22 |
-8.72 |
-1.21 |
0 |
|
|
36119 |
7980786 |
1 |
N2O4H20C23 |
A2B4C20D23 |
-82.16 |
1.22 |
-9.06 |
-0.99 |
0 |
|
|
36120 |
7980787 |
1 |
ClNO3H18C21 |
ABC3D18E21 |
-78.7 |
4.59 |
-9.38 |
-1.18 |
0 |
|
|
36121 |
7980788 |
1 |
ClNO3H18C21 |
ABC3D18E21 |
-79.01 |
2.74 |
-9.36 |
-1.16 |
0 |
|
|
36122 |
7980789 |
1 |
NO6H17C22 |
AB6C17D22 |
-167.86 |
4.88 |
-8.87 |
-1.04 |
0 |
|
|
36123 |
7980790 |
1 |
NSO4H19C23 |
ABC4D19E23 |
-59.96 |
4.87 |
-8.65 |
-0.87 |
0 |
|
|
36124 |
7980791 |
1 |
N3O4H23C24 |
A3B4C23D24 |
-105.83 |
9.05 |
-8.49 |
-0.58 |
0 |
|
|
36125 |
7980792 |
1 |
SN2O5C20H22 |
AB2C5D20E22 |
-168.54 |
11.18 |
-8.38 |
-0.54 |
0 |
|
|
36126 |
7980793 |
1 |
N3O5H21C23 |
A3B5C21D23 |
-66.61 |
5.55 |
-8.57 |
-1.7 |
0 |
|
|
36127 |
7980794 |
1 |
N2O3C25H26 |
A2B3C25D26 |
-70.94 |
1.64 |
-8.94 |
-0.76 |
0 |
|
|
36128 |
7980795 |
1 |
N3O4C19H19 |
A3B4C19D19 |
-100.19 |
3.76 |
-9.1 |
-0.88 |
0 |
|
|
36129 |
7980796 |
1 |
N3O4C24H27 |
A3B4C24D27 |
-129.85 |
5.18 |
-8.69 |
-0.61 |
0 |
|
|
36130 |
7980797 |
1 |
N2O3C23H24 |
A2B3C23D24 |
-68.06 |
12.53 |
-8.16 |
-0.29 |
0 |
|
|
36131 |
7980798 |
1 |
N2O3H22C23 |
A2B3C22D23 |
-58.36 |
7.72 |
-8.4 |
-0.48 |
0 |
|
|
36132 |
7980800 |
1 |
N3O4H23C24 |
A3B4C23D24 |
-102.67 |
7.89 |
-8.52 |
-0.89 |
0 |
|
|
36133 |
7980801 |
1 |
N3O4H23C24 |
A3B4C23D24 |
-102.54 |
12.11 |
-8.31 |
-0.46 |
0 |
|
|
36134 |
7980802 |
2 |
NO2H11C12 |
AB2C11D12 |
-97.12 |
3.73 |
-8.92 |
-0.89 |
0 |
|
|
36135 |
7980803 |
2 |
NO2H11C12 |
AB2C11D12 |
-99.6 |
7.31 |
-8.98 |
-0.84 |
0 |
|
|
36136 |
7980804 |
1 |
ClN2O3H19C22 |
AB2C3D19E22 |
-62.61 |
5.83 |
-9.05 |
-0.79 |
0 |
|
|
36137 |
7980805 |
1 |
ClN2O3H19C22 |
AB2C3D19E22 |
-62.56 |
5.96 |
-9.01 |
-0.97 |
0 |
|
|
36138 |
7980807 |
1 |
N2O3C24H24 |
A2B3C24D24 |
-69.64 |
4.91 |
-8.42 |
-0.67 |
0 |
|
|
36139 |
7980808 |
1 |
NO3C25H27 |
AB3C25D27 |
-91.91 |
8.85 |
-8.35 |
-0.48 |
0 |
|
|
36140 |
7980809 |
1 |
N3O5H19C22 |
A3B5C19D22 |
-55.93 |
7.59 |
-9.04 |
-1.42 |
0 |
|
|
36141 |
7980810 |
1 |
ClN3O3H16C20 |
AB3C3D16E20 |
-38.93 |
4.85 |
-8.54 |
-1.17 |
0 |
|
|
36142 |
7980811 |
1 |
F2N2O3H16C21 |
A2B2C3D16E21 |
-139.32 |
6.26 |
-9.01 |
-0.88 |
0 |
|
|
36143 |
7980812 |
1 |
N2O3H24C25 |
A2B3C24D25 |
-60.98 |
4.77 |
-8.74 |
-0.54 |
0 |
|
|
36144 |
7980813 |
1 |
N2O5C24H24 |
A2B5C24D24 |
-155.33 |
13.61 |
-8.18 |
-0.74 |
0 |
|
|
36145 |
7980814 |
1 |
NO5H21C23 |
AB5C21D23 |
-112.49 |
11.54 |
-8.34 |
-1.07 |
0 |
|
|
36146 |
7980817 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-84.09 |
3.38 |
-9.0 |
-0.84 |
0 |
|
|
36147 |
7980818 |
1 |
FN2O3H19C22 |
AB2C3D19E22 |
-100.2 |
2.5 |
-8.77 |
-0.79 |
0 |
|
|
36148 |
7980819 |
2 |
FNO2H9C11 |
ABC2D9E11 |
-192.03 |
5.71 |
-8.7 |
-0.82 |
0 |
|
|
36149 |
7980821 |
1 |
N2O3H22C23 |
A2B3C22D23 |
-58.03 |
8.17 |
-8.58 |
-0.57 |
0 |