List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
293725 |
117397670 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-105.45 |
6.2 |
-8.9 |
-0.63 |
0 |
|
|
293726 |
117397671 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-106.11 |
7.77 |
-8.83 |
-0.4 |
0 |
|
|
293727 |
117397759 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-89.8 |
3.51 |
-8.89 |
-0.09 |
0 |
|
|
293728 |
117397770 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-107.7 |
2.0 |
-8.66 |
-0.32 |
0 |
|
|
293729 |
117397808 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-97.9 |
1.99 |
-8.64 |
-0.45 |
0 |
|
|
293730 |
117397819 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-118.26 |
2.86 |
-8.76 |
-0.16 |
0 |
|
|
293731 |
117397855 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-104.68 |
0.09 |
-8.52 |
-0.4 |
0 |
|
|
293732 |
117397863 |
1 |
ClNO3C12H16 |
ABC3D12E16 |
-100.73 |
2.24 |
-8.95 |
-0.44 |
0 |
|
|
293733 |
117397955 |
1 |
ClFNOC13H17 |
ABCDE13F17 |
-65.04 |
3.05 |
-9.46 |
-0.4 |
0 |
|
|
293734 |
117398124 |
1 |
ClNO2C13H20 |
ABC2D13E20 |
-84.48 |
0.81 |
-8.7 |
-0.1 |
0 |
|
|
293735 |
117398139 |
1 |
ClNO2C13H20 |
ABC2D13E20 |
-79.47 |
2.56 |
-8.19 |
0.05 |
0 |
|
|
293736 |
117398222 |
1 |
ClNO2C13H20 |
ABC2D13E20 |
-82.32 |
2.95 |
-8.62 |
-0.13 |
0 |
|
|
293737 |
117398251 |
1 |
ClNSC13H20 |
ABCD13E20 |
-14.8 |
3.55 |
-8.68 |
-0.31 |
0 |
|
|
293738 |
117398371 |
1 |
BrNO2C10H12 |
ABC2D10E12 |
-44.27 |
3.02 |
-8.77 |
-0.17 |
0 |
|
|
293739 |
117398522 |
1 |
BrNOC11H16 |
ABCD11E16 |
-30.34 |
1.24 |
-9.28 |
-0.14 |
0 |
|
|
293740 |
117398523 |
1 |
BrNOC11H16 |
ABCD11E16 |
-29.49 |
3.27 |
-8.87 |
0.01 |
0 |
|
|
293741 |
117398812 |
1 |
O2F3C13H13 |
A2B3C13D13 |
-227.53 |
4.23 |
-10.45 |
-0.94 |
0 |
|
|
293742 |
117398813 |
1 |
O2F3C13H13 |
A2B3C13D13 |
-216.53 |
4.06 |
-10.15 |
-0.82 |
0 |
|
|
293743 |
117398873 |
1 |
FO5C12H15 |
AB5C12D15 |
-241.27 |
5.37 |
-8.83 |
-0.54 |
0 |
|
|
293744 |
117398976 |
1 |
F2O3C13H16 |
A2B3C13D16 |
-229.29 |
6.66 |
-9.24 |
-0.45 |
0 |
|
|
293745 |
117399283 |
1 |
SO5C11H14 |
AB5C11D14 |
-216.31 |
3.01 |
-9.53 |
-0.7 |
0 |
|
|
293746 |
117399298 |
1 |
SO5C11H14 |
AB5C11D14 |
-204.15 |
7.72 |
-9.76 |
-0.96 |
0 |
|
|
293747 |
117399420 |
1 |
O3C16H18 |
A3B16C18 |
-71.09 |
3.5 |
-8.48 |
-0.46 |
0 |
|
|
293748 |
117399511 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-16.62 |
5.8 |
-8.62 |
-0.44 |
0 |
|
|
293749 |
117399512 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-14.38 |
4.13 |
-8.75 |
-0.35 |
0 |
|
|
293750 |
117399949 |
1 |
N2C17H26 |
A2B17C26 |
-1.44 |
0.52 |
-8.78 |
0.4 |
0 |
|
|
293751 |
117399950 |
1 |
N2C17H26 |
A2B17C26 |
-0.97 |
2.86 |
-8.68 |
0.42 |
0 |
|
|
293752 |
117400431 |
1 |
ClO4C12H15 |
AB4C12D15 |
-166.29 |
3.79 |
-9.59 |
-0.48 |
0 |
|
|
293753 |
117400477 |
1 |
ClO4C12H15 |
AB4C12D15 |
-168.7 |
8.99 |
-8.92 |
-0.45 |
0 |
|
|
293754 |
117400499 |
1 |
ClO4C12H15 |
AB4C12D15 |
-170.11 |
6.03 |
-8.58 |
-0.23 |
0 |
|
|
293755 |
117400500 |
1 |
ClO4C12H15 |
AB4C12D15 |
-168.0 |
6.61 |
-9.27 |
-0.62 |
0 |
|
|
293756 |
117400537 |
1 |
ClO4C12H15 |
AB4C12D15 |
-180.28 |
3.66 |
-9.2 |
-0.71 |
0 |
|
|
293757 |
117400538 |
1 |
ClO4C12H15 |
AB4C12D15 |
-173.58 |
1.46 |
-9.3 |
-0.54 |
0 |
|
|
293758 |
117400608 |
1 |
ClFO2C13H16 |
ABC2D13E16 |
-148.56 |
4.88 |
-9.82 |
-0.49 |
0 |
|
|
293759 |
117400625 |
1 |
ClFON2C12H16 |
ABCD2E12F16 |
-65.21 |
3.79 |
-8.91 |
-0.45 |
0 |
|
|
293760 |
117400626 |
1 |
ClFON2C12H16 |
ABCD2E12F16 |
-63.88 |
3.44 |
-8.99 |
-0.46 |
0 |
|
|
293761 |
117400738 |
1 |
BrO4H7C9 |
AB4C7D9 |
-117.84 |
2.62 |
-9.42 |
-1.62 |
0 |
|
|
293762 |
117400751 |
1 |
BrO4H7C9 |
AB4C7D9 |
-131.81 |
4.84 |
-9.75 |
-1.86 |
0 |
|
|
293763 |
117400774 |
1 |
BrO3C10H11 |
AB3C10D11 |
-113.32 |
2.63 |
-9.56 |
-0.45 |
0 |
|
|
293764 |
117400777 |
1 |
BrO3C10H11 |
AB3C10D11 |
-109.58 |
3.02 |
-9.95 |
-0.54 |
0 |
|
|
293765 |
117400782 |
1 |
BrO3C10H11 |
AB3C10D11 |
-95.07 |
1.49 |
-9.12 |
-0.51 |
0 |
|
|
293766 |
117400792 |
1 |
BrO3C10H11 |
AB3C10D11 |
-120.79 |
6.77 |
-9.39 |
-0.6 |
0 |
|
|
293767 |
117400863 |
1 |
BrFOC11H12 |
ABCD11E12 |
-72.23 |
3.09 |
-9.64 |
-0.41 |
0 |
|
|
293768 |
117400866 |
1 |
BrFOC11H12 |
ABCD11E12 |
-77.73 |
2.76 |
-9.43 |
-0.31 |
0 |
|
|
293769 |
117400920 |
1 |
BrO2C11H15 |
AB2C11D15 |
-88.36 |
3.78 |
-8.96 |
-0.22 |
0 |
|
|
293770 |
117400923 |
1 |
BrO2C11H15 |
AB2C11D15 |
-83.81 |
3.16 |
-8.92 |
0.06 |
0 |
|
|
293771 |
117400936 |
1 |
BrO2C11H15 |
AB2C11D15 |
-77.92 |
1.59 |
-8.73 |
-0.12 |
0 |
|
|
293772 |
117401042 |
1 |
BrOSC10H11 |
ABCD10E11 |
-0.94 |
4.23 |
-8.84 |
-0.48 |
0 |
|
|
293773 |
117401066 |
1 |
O2F3N3H8C10 |
A2B3C3D8E10 |
-129.74 |
4.5 |
-9.4 |
-1.79 |
0 |
|
|
293774 |
117401074 |
1 |
FNO6C10H10 |
ABC6D10E10 |
-205.78 |
7.37 |
-9.92 |
-1.47 |
0 |
|
|
293775 |
117401076 |
1 |
FNO6C10H10 |
ABC6D10E10 |
-192.39 |
6.65 |
-10.12 |
-1.64 |
0 |
|
|
293776 |
117401089 |
1 |
N3F4H9C11 |
A3B4C9D11 |
-143.36 |
4.48 |
-9.37 |
-0.87 |
0 |
|
|
293777 |
117401098 |
1 |
NF2O4C11H11 |
AB2C4D11E11 |
-234.53 |
5.1 |
-9.53 |
-0.92 |
0 |
|
|
293778 |
117401100 |
1 |
NF2O4C11H11 |
AB2C4D11E11 |
-238.85 |
5.43 |
-9.54 |
-0.94 |
0 |
|
|
293779 |
117401152 |
1 |
NO2F3C12H12 |
AB2C3D12E12 |
-196.12 |
4.66 |
-9.22 |
-0.67 |
0 |
|
|
293780 |
117401199 |
1 |
NF2O3C12H15 |
AB2C3D12E15 |
-178.85 |
1.4 |
-8.82 |
-0.46 |
0 |
|
|
293781 |
117401200 |
1 |
NF2O3C12H15 |
AB2C3D12E15 |
-181.04 |
1.59 |
-9.01 |
-0.34 |
0 |
|
|
293782 |
117401357 |
1 |
N3O3C13H13 |
A3B3C13D13 |
-45.75 |
5.56 |
-8.77 |
-0.64 |
0 |
|
|
293783 |
117401533 |
1 |
NSO5C10H13 |
ABC5D10E13 |
-146.0 |
6.42 |
-9.22 |
-0.69 |
0 |
|
|
293784 |
117401646 |
1 |
NO3C15H17 |
AB3C15D17 |
-85.73 |
4.23 |
-8.74 |
-0.11 |
0 |
|
|
293785 |
117401823 |
1 |
NO3C15H17 |
AB3C15D17 |
-88.67 |
3.69 |
-8.74 |
-0.75 |
0 |
|
|
293786 |
117401851 |
1 |
NO3C15H17 |
AB3C15D17 |
-102.65 |
7.04 |
-9.61 |
-1.04 |
0 |
|
|
293787 |
117401906 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-24.72 |
4.54 |
-9.22 |
-0.72 |
0 |
|
|
293788 |
117401918 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-5.6 |
3.05 |
-8.59 |
-1.45 |
0 |
|
|
293789 |
117401929 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-21.44 |
3.27 |
-8.71 |
0.06 |
0 |
|
|
293790 |
117401966 |
1 |
O2N3C14H17 |
A2B3C14D17 |
12.41 |
3.09 |
-8.13 |
0.14 |
0 |
|
|
293791 |
117401974 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-1.85 |
2.45 |
-8.46 |
-0.07 |
0 |
|
|
293792 |
117401982 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-20.0 |
4.65 |
-9.07 |
-0.61 |
0 |
|
|
293793 |
117402018 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-31.71 |
5.01 |
-8.88 |
-0.45 |
0 |
|
|
293794 |
117402031 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-34.33 |
2.3 |
-9.01 |
-0.33 |
0 |
|
|
293795 |
117402032 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-41.03 |
1.38 |
-9.22 |
-0.32 |
0 |
|
|
293796 |
117402044 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-49.39 |
2.17 |
-9.04 |
-0.22 |
0 |
|
|
293797 |
117402118 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-67.18 |
5.56 |
-8.98 |
-0.94 |
0 |
|
|
293798 |
117402351 |
1 |
NO2C16H21 |
AB2C16D21 |
-47.54 |
1.83 |
-9.0 |
-0.13 |
0 |
|
|
293799 |
117402433 |
1 |
ON3C15H21 |
AB3C15D21 |
-22.02 |
4.53 |
-8.49 |
0.24 |
0 |