List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
285700 |
104120139 |
1 |
BrFN2O2H12C13 |
ABC2D2E12F13 |
-28.53 |
3.56 |
-9.41 |
-0.81 |
0 |
|
|
285701 |
104120286 |
1 |
F2N2O2C7H10 |
A2B2C2D7E10 |
-137.88 |
3.26 |
-9.25 |
-0.3 |
0 |
|
|
285702 |
104120353 |
1 |
N2O3C14H26 |
A2B3C14D26 |
-128.36 |
0.99 |
-9.03 |
0.2 |
0 |
|
|
285703 |
104120360 |
1 |
N2O3C11H18 |
A2B3C11D18 |
-109.65 |
1.46 |
-9.37 |
0.1 |
0 |
|
|
285704 |
104120624 |
1 |
BrN3C10H16 |
AB3C10D16 |
23.12 |
3.78 |
-8.64 |
-0.23 |
0 |
|
|
285705 |
104120625 |
1 |
N3C10H17 |
A3B10C17 |
18.57 |
3.58 |
-8.68 |
0.17 |
0 |
|
|
285706 |
104120661 |
1 |
BrN3C11H18 |
AB3C11D18 |
18.31 |
3.76 |
-8.94 |
-0.36 |
0 |
|
|
285707 |
104120665 |
2 |
N2C5H9 |
A2B5C9 |
26.85 |
3.92 |
-8.75 |
-0.17 |
0 |
|
|
285708 |
104120842 |
1 |
N4C11H20 |
A4B11C20 |
16.31 |
2.8 |
-8.65 |
-0.26 |
0 |
|
|
285709 |
104121028 |
1 |
N3C17H25 |
A3B17C25 |
7.91 |
5.76 |
-8.45 |
-0.32 |
0 |
|
|
285710 |
104121064 |
1 |
N3C14H25 |
A3B14C25 |
-16.26 |
3.64 |
-8.68 |
0.19 |
0 |
|
|
285711 |
104121165 |
1 |
N3C10H15 |
A3B10C15 |
38.89 |
5.21 |
-8.88 |
0.18 |
0 |
|
|
285712 |
104121364 |
1 |
ClN3C11H18 |
AB3C11D18 |
-4.49 |
4.62 |
-8.48 |
-0.04 |
0 |
|
|
285713 |
104121457 |
3 |
NC4H7 |
AB4C7 |
2.98 |
1.51 |
-8.29 |
0.4 |
0 |
|
|
285714 |
104121459 |
2 |
N2C6H11 |
A2B6C11 |
6.84 |
0.78 |
-8.6 |
0.18 |
0 |
|
|
285715 |
104121466 |
1 |
N3C17H25 |
A3B17C25 |
15.14 |
3.57 |
-8.33 |
-0.24 |
0 |
|
|
285716 |
104121538 |
1 |
N4C11H20 |
A4B11C20 |
11.8 |
1.42 |
-8.66 |
0.08 |
0 |
|
|
285717 |
104121691 |
1 |
O2N3C12H13 |
A2B3C12D13 |
-29.73 |
3.49 |
-9.52 |
-1.27 |
0 |
|
|
285718 |
104121736 |
1 |
NO3C15H15 |
AB3C15D15 |
-87.07 |
5.37 |
-9.16 |
-0.93 |
0 |
|
|
285719 |
104121757 |
1 |
NO4C15H15 |
AB4C15D15 |
-113.81 |
3.86 |
-9.03 |
-0.94 |
0 |
|
|
285720 |
104121859 |
1 |
ClN2O5H9C13 |
AB2C5D9E13 |
-75.62 |
5.59 |
-10.14 |
-1.81 |
0 |
|
|
285721 |
104121860 |
1 |
NO4C15H15 |
AB4C15D15 |
-114.94 |
6.79 |
-9.13 |
-0.94 |
0 |
|
|
285722 |
104121861 |
1 |
FN2O5H9C13 |
AB2C5D9E13 |
-111.96 |
5.7 |
-10.14 |
-1.88 |
0 |
|
|
285723 |
104121866 |
1 |
NF2O3H9C13 |
AB2C3D9E13 |
-153.99 |
5.79 |
-9.94 |
-1.06 |
0 |
|
|
285724 |
104122086 |
1 |
ClO2N3H14C15 |
AB2C3D14E15 |
-49.46 |
4.57 |
-8.9 |
-1.06 |
0 |
|
|
285725 |
104122106 |
1 |
ClON3H12C13 |
ABC3D12E13 |
9.68 |
4.3 |
-10.09 |
-0.95 |
0 |
|
|
285726 |
104122154 |
1 |
ClON2C12H15 |
ABC2D12E15 |
-26.69 |
3.5 |
-9.97 |
-0.8 |
0 |
|
|
285727 |
104122182 |
1 |
ClN2O2C12H15 |
AB2C2D12E15 |
-70.72 |
3.39 |
-9.67 |
-0.76 |
0 |
|
|
285728 |
104122183 |
1 |
ClN2O2C13H17 |
AB2C2D13E17 |
-78.97 |
3.19 |
-9.58 |
-0.76 |
0 |
|
|
285729 |
104122184 |
1 |
ClO2N3C10H12 |
AB2C3D10E12 |
-74.25 |
4.41 |
-9.94 |
-0.86 |
0 |
|
|
285730 |
104122638 |
1 |
ClON2C17H19 |
ABC2D17E19 |
-15.24 |
5.34 |
-9.31 |
-0.61 |
0 |
|
|
285731 |
104122675 |
1 |
ClO2N3C15H20 |
AB2C3D15E20 |
-88.43 |
3.75 |
-9.87 |
-0.76 |
0 |
|
|
285732 |
104122693 |
1 |
ClON3C16H18 |
ABC3D16E18 |
0.09 |
1.72 |
-9.79 |
-0.94 |
0 |
|
|
285733 |
104123053 |
1 |
ClON2C14H21 |
ABC2D14E21 |
-59.06 |
3.69 |
-9.94 |
-0.75 |
0 |
|
|
285734 |
104123237 |
1 |
ClN2O2C16H21 |
AB2C2D16E21 |
-94.42 |
4.63 |
-9.6 |
-0.62 |
0 |
|
|
285735 |
104123281 |
1 |
ClON2C11H13 |
ABC2D11E13 |
-8.06 |
4.97 |
-9.78 |
-0.7 |
0 |
|
|
285736 |
104123331 |
1 |
ClON2C17H25 |
ABC2D17E25 |
-71.36 |
3.72 |
-9.92 |
-0.71 |
0 |
|
|
285737 |
104123411 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-87.55 |
5.74 |
-8.9 |
-0.44 |
0 |
|
|
285738 |
104123672 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-122.92 |
6.92 |
-8.85 |
-0.64 |
0 |
|
|
285739 |
104123843 |
2 |
NOC8H9 |
ABC8D9 |
-45.04 |
5.72 |
-8.81 |
-0.55 |
0 |
|
|
285740 |
104123899 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-68.04 |
6.93 |
-8.79 |
-0.38 |
0 |
|
|
285741 |
104124070 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-89.56 |
5.6 |
-8.86 |
-0.43 |
0 |
|
|
285742 |
104124163 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-71.87 |
5.95 |
-8.89 |
-0.56 |
0 |
|
|
285743 |
104124181 |
1 |
N2O2C11H12 |
A2B2C11D12 |
-2.59 |
5.08 |
-9.01 |
-0.57 |
0 |
|
|
285744 |
104124288 |
1 |
SO3N4H10C11 |
AB3C4D10E11 |
-60.38 |
10.78 |
-9.78 |
-1.38 |
0 |
|
|
285745 |
104124291 |
1 |
SO2N3H11C12 |
AB2C3D11E12 |
-16.79 |
5.03 |
-9.09 |
-1.1 |
0 |
|
|
285746 |
104124307 |
1 |
NSO3C12H15 |
ABC3D12E15 |
-112.59 |
4.44 |
-9.11 |
-1.05 |
0 |
|
|
285747 |
104124432 |
1 |
FON2C15H17 |
ABC2D15E17 |
-50.6 |
2.63 |
-8.51 |
-0.14 |
0 |
|
|
285748 |
104124723 |
1 |
BrNO2H14C17 |
ABC2D14E17 |
-17.11 |
1.73 |
-8.95 |
-0.85 |
0 |
|
|
285749 |
104125109 |
1 |
ClN2C14H23 |
AB2C14D23 |
-21.36 |
1.04 |
-8.25 |
0.14 |
0 |
|
|
285750 |
104125662 |
1 |
OSN4C13H16 |
ABC4D13E16 |
14.3 |
5.13 |
-8.9 |
-0.62 |
0 |
|
|
285751 |
104125675 |
1 |
ON3C14H21 |
AB3C14D21 |
-38.98 |
3.4 |
-8.7 |
0.02 |
0 |
|
|
285752 |
104125924 |
1 |
ON3C15H17 |
AB3C15D17 |
-9.53 |
3.85 |
-9.01 |
-0.25 |
0 |
|
|
285753 |
104126143 |
1 |
ClFON3H13C14 |
ABCD3E13F14 |
-46.13 |
3.74 |
-8.97 |
-0.65 |
0 |
|
|
285754 |
104126335 |
1 |
ON4C14H16 |
AB4C14D16 |
6.18 |
2.71 |
-8.84 |
-0.19 |
0 |
|
|
285755 |
104126447 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-86.14 |
4.88 |
-8.53 |
-0.1 |
0 |
|
|
285756 |
104126535 |
1 |
ON3C16H25 |
AB3C16D25 |
-25.88 |
2.84 |
-8.72 |
0.04 |
0 |
|
|
285757 |
104126556 |
1 |
ClOSN3C14H16 |
ABCD3E14F16 |
-1.93 |
4.0 |
-8.76 |
-0.59 |
0 |
|
|
285758 |
104127177 |
1 |
ON3C12H17 |
AB3C12D17 |
-10.74 |
4.13 |
-8.72 |
-0.17 |
0 |
|
|
285759 |
104127178 |
1 |
ON3C15H23 |
AB3C15D23 |
-53.48 |
4.68 |
-8.96 |
-0.16 |
0 |
|
|
285760 |
104128390 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-15.76 |
3.26 |
-8.99 |
-0.56 |
0 |
|
|
285761 |
104128491 |
1 |
ON4C13H22 |
AB4C13D22 |
-31.57 |
2.44 |
-9.07 |
-0.43 |
0 |
|
|
285762 |
104128497 |
1 |
ON4C12H18 |
AB4C12D18 |
0.68 |
2.81 |
-9.11 |
-0.44 |
0 |
|
|
285763 |
104128616 |
2 |
ON2C7H11 |
AB2C7D11 |
-65.28 |
4.35 |
-9.06 |
-0.35 |
0 |
|
|
285764 |
104128861 |
1 |
OSN5C11H13 |
ABC5D11E13 |
37.62 |
2.51 |
-9.13 |
-0.78 |
0 |
|
|
285765 |
104129241 |
1 |
N3C17H21 |
A3B17C21 |
43.1 |
1.03 |
-8.35 |
0.27 |
0 |
|
|
285766 |
104129289 |
1 |
N3C15H25 |
A3B15C25 |
-2.62 |
0.57 |
-8.17 |
0.55 |
0 |
|
|
285767 |
104129292 |
1 |
N3C16H19 |
A3B16C19 |
42.48 |
1.08 |
-8.04 |
0.02 |
0 |
|
|
285768 |
104129367 |
1 |
N3C14H25 |
A3B14C25 |
-2.34 |
1.76 |
-8.03 |
0.67 |
0 |
|
|
285769 |
104129512 |
1 |
N3C14H23 |
A3B14C23 |
-2.5 |
2.56 |
-8.27 |
0.42 |
0 |
|
|
285770 |
104129819 |
1 |
N3C15H25 |
A3B15C25 |
-8.48 |
2.41 |
-8.34 |
0.38 |
0 |
|
|
285771 |
104129857 |
1 |
BrSN3C16H20 |
ABC3D16E20 |
70.45 |
2.69 |
-8.62 |
-0.49 |
0 |
|
|
285772 |
104130505 |
1 |
N3C16H25 |
A3B16C25 |
43.85 |
1.73 |
-8.38 |
0.3 |
0 |
|
|
285773 |
104130540 |
1 |
F3N3C14H22 |
A3B3C14D22 |
-160.78 |
5.05 |
-8.66 |
0.15 |
0 |
|
|
285774 |
104130656 |
1 |
N3C18H29 |
A3B18C29 |
11.53 |
1.34 |
-8.1 |
0.59 |
0 |