List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
246100 |
103044292 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-8.96 |
6.02 |
-8.66 |
-0.44 |
0 |
|
|
246101 |
103044297 |
1 |
ClFN3C14H15 |
ABC3D14E15 |
3.3 |
4.46 |
-9.46 |
-0.45 |
0 |
|
|
246102 |
103044330 |
1 |
ON2C13H16 |
AB2C13D16 |
0.67 |
4.18 |
-8.78 |
-0.51 |
0 |
|
|
246103 |
103044372 |
1 |
N3O3H11C15 |
A3B3C11D15 |
-10.25 |
2.04 |
-9.38 |
-1.37 |
0 |
|
|
246104 |
103044381 |
1 |
N2O3H10C15 |
A2B3C10D15 |
-30.86 |
4.19 |
-9.51 |
-1.42 |
0 |
|
|
246105 |
103044432 |
1 |
NO3H13C17 |
AB3C13D17 |
-48.34 |
4.52 |
-9.32 |
-1.13 |
0 |
|
|
246106 |
103044476 |
1 |
ON2C15H20 |
AB2C15D20 |
-7.88 |
3.44 |
-9.02 |
-0.7 |
0 |
|
|
246107 |
103044765 |
1 |
ClON2H9C12 |
ABC2D9E12 |
34.72 |
2.66 |
-9.17 |
-0.86 |
0 |
|
|
246108 |
103044800 |
1 |
OSN3H11C15 |
ABC3D11E15 |
66.4 |
4.56 |
-8.5 |
-1.27 |
0 |
|
|
246109 |
103045104 |
1 |
FNO2H10C16 |
ABC2D10E16 |
-29.87 |
3.33 |
-9.62 |
-1.24 |
0 |
|
|
246110 |
103045105 |
1 |
NO2H13C17 |
AB2C13D17 |
4.56 |
3.11 |
-9.51 |
-1.1 |
0 |
|
|
246111 |
103045106 |
1 |
ClNO2H10C16 |
ABC2D10E16 |
7.06 |
3.47 |
-9.5 |
-1.26 |
0 |
|
|
246112 |
103045107 |
1 |
ClNO2H10C16 |
ABC2D10E16 |
10.11 |
4.02 |
-9.18 |
-1.0 |
0 |
|
|
246113 |
103045108 |
1 |
NO2H11C16 |
AB2C11D16 |
17.58 |
1.47 |
-9.4 |
-1.06 |
0 |
|
|
246114 |
103045109 |
1 |
NO2H11C16 |
AB2C11D16 |
15.0 |
1.97 |
-9.22 |
-1.07 |
0 |
|
|
246115 |
103045110 |
1 |
NSO2H9C14 |
ABC2D9E14 |
22.96 |
2.23 |
-9.3 |
-1.32 |
0 |
|
|
246116 |
103045115 |
1 |
ClNO2H10C16 |
ABC2D10E16 |
5.46 |
2.16 |
-9.79 |
-1.24 |
0 |
|
|
246117 |
103045170 |
1 |
FNO2H14C17 |
ABC2D14E17 |
-57.59 |
2.42 |
-9.46 |
-0.9 |
0 |
|
|
246118 |
103045256 |
1 |
NO2C15H17 |
AB2C15D17 |
-41.65 |
1.5 |
-9.04 |
-0.74 |
0 |
|
|
246119 |
103045273 |
1 |
ON2C18H18 |
AB2C18D18 |
36.6 |
3.13 |
-8.9 |
-0.87 |
0 |
|
|
246120 |
103045274 |
1 |
BrON2H15C17 |
ABC2D15E17 |
45.64 |
3.86 |
-8.98 |
-0.81 |
0 |
|
|
246121 |
103045306 |
1 |
SN2O3C12H12 |
AB2C3D12E12 |
-46.29 |
6.96 |
-9.88 |
-1.43 |
0 |
|
|
246122 |
103045316 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-87.33 |
9.24 |
-9.32 |
-0.98 |
0 |
|
|
246123 |
103045323 |
1 |
SN2O3H8C9 |
AB2C3D8E9 |
-77.37 |
5.48 |
-9.16 |
-1.46 |
0 |
|
|
246124 |
103045327 |
1 |
SN2O3C14H16 |
AB2C3D14E16 |
-68.34 |
8.69 |
-9.45 |
-1.13 |
0 |
|
|
246125 |
103045379 |
1 |
NO2C15H17 |
AB2C15D17 |
-55.23 |
4.14 |
-8.84 |
-0.58 |
0 |
|
|
246126 |
103045403 |
1 |
N3O3H11C15 |
A3B3C11D15 |
-30.02 |
7.65 |
-9.12 |
-1.21 |
0 |
|
|
246127 |
103045404 |
1 |
N2O3H12C16 |
A2B3C12D16 |
-40.35 |
3.69 |
-9.07 |
-1.08 |
0 |
|
|
246128 |
103045405 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-18.0 |
3.05 |
-9.32 |
-0.79 |
0 |
|
|
246129 |
103045653 |
1 |
OSN4H12C13 |
ABC4D12E13 |
68.84 |
5.66 |
-9.02 |
-0.83 |
0 |
|
|
246130 |
103046125 |
1 |
BrON4H9C13 |
ABC4D9E13 |
55.46 |
5.13 |
-9.24 |
-0.86 |
0 |
|
|
246131 |
103046228 |
1 |
ClFNO2H13C14 |
ABCD2E13F14 |
-83.45 |
1.95 |
-7.94 |
-0.41 |
0 |
|
|
246132 |
103046379 |
1 |
ClFNOC16H17 |
ABCDE16F17 |
-53.69 |
0.49 |
-8.86 |
-0.49 |
0 |
|
|
246133 |
103046586 |
1 |
ClFSN2C10H12 |
ABCD2E10F12 |
-21.75 |
4.88 |
-8.59 |
-0.7 |
0 |
|
|
246134 |
103046591 |
1 |
ClFSN2H14C15 |
ABCD2E14F15 |
6.29 |
6.22 |
-8.51 |
-0.74 |
0 |
|
|
246135 |
103046593 |
1 |
ClFOSN2C13H18 |
ABCDE2F13G18 |
-66.26 |
4.53 |
-8.79 |
-0.42 |
0 |
|
|
246136 |
103046599 |
1 |
ClFSN2C13H16 |
ABCD2E13F16 |
-31.8 |
3.84 |
-8.71 |
-0.54 |
0 |
|
|
246137 |
103046602 |
1 |
ClFN2S2C14H18 |
ABC2D2E14F18 |
-32.72 |
3.09 |
-8.76 |
-0.58 |
0 |
|
|
246138 |
103046605 |
1 |
ClFNOSH11C14 |
ABCDEF11G14 |
-35.18 |
6.5 |
-8.52 |
-0.96 |
0 |
|
|
246139 |
103046606 |
1 |
ClFNOSH11C14 |
ABCDEF11G14 |
-32.44 |
3.8 |
-8.76 |
-0.87 |
0 |
|
|
246140 |
103046607 |
1 |
ClFNSO2H13C15 |
ABCDE2F13G15 |
-68.85 |
4.61 |
-8.57 |
-0.71 |
0 |
|
|
246141 |
103046608 |
1 |
ClFNOSH13C15 |
ABCDEF13G15 |
-40.51 |
5.64 |
-8.63 |
-0.75 |
0 |
|
|
246142 |
103046609 |
1 |
ClNOSF2H10C14 |
ABCDE2F10G14 |
-84.02 |
3.03 |
-8.36 |
-1.05 |
0 |
|
|
246143 |
103046610 |
1 |
FNOSCl2H10C14 |
ABCDE2F10G14 |
-39.47 |
3.85 |
-8.76 |
-0.98 |
0 |
|
|
246144 |
103046613 |
1 |
FNOSCl2H10C14 |
ABCDE2F10G14 |
-44.57 |
3.5 |
-8.39 |
-1.08 |
0 |
|
|
246145 |
103046622 |
1 |
ClFNOC14H17 |
ABCDE14F17 |
-81.69 |
4.56 |
-9.22 |
-0.45 |
0 |
|
|
246146 |
103046623 |
1 |
ClFNOC16H19 |
ABCDE16F19 |
-87.03 |
4.37 |
-8.92 |
-0.1 |
0 |
|
|
246147 |
103046624 |
1 |
ClFNOC17H21 |
ABCDE17F21 |
-93.32 |
1.46 |
-9.14 |
-0.3 |
0 |
|
|
246148 |
103046626 |
1 |
ClFNOC16H21 |
ABCDE16F21 |
-91.02 |
1.6 |
-9.0 |
-0.28 |
0 |
|
|
246149 |
103046653 |
1 |
ClFSO4C10H10 |
ABCD4E10F10 |
-208.86 |
3.3 |
-9.88 |
-0.89 |
0 |