List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
336726 |
127255733 |
1 |
ClNOH8C9 |
ABCD8E9 |
-26.7 |
5.48 |
-8.96 |
-0.82 |
0 |
|
|
336727 |
127255734 |
1 |
ClNOH8C9 |
ABCD8E9 |
-31.26 |
6.72 |
-9.05 |
-0.4 |
0 |
|
|
336728 |
127255735 |
1 |
ClNOH8C9 |
ABCD8E9 |
-25.0 |
4.59 |
-8.66 |
-0.75 |
0 |
|
|
336729 |
127255736 |
1 |
BrNOH8C9 |
ABCD8E9 |
-18.59 |
6.7 |
-9.07 |
-0.46 |
0 |
|
|
336730 |
127255737 |
1 |
INOH8C9 |
ABCD8E9 |
0.58 |
4.15 |
-8.89 |
-1.09 |
0 |
|
|
336731 |
127255738 |
1 |
IO2H9C10 |
AB2C9D10 |
-39.57 |
3.5 |
-9.15 |
-1.11 |
0 |
|
|
336732 |
127255739 |
1 |
IO2H9C10 |
AB2C9D10 |
-39.73 |
2.11 |
-9.44 |
-1.15 |
0 |
|
|
336733 |
127255740 |
1 |
IO2H9C10 |
AB2C9D10 |
-36.02 |
2.99 |
-9.15 |
-1.09 |
0 |
|
|
336734 |
127255741 |
1 |
FO2H7C9 |
AB2C7D9 |
-109.94 |
2.81 |
-9.8 |
-0.69 |
0 |
|
|
336735 |
127255742 |
1 |
FO2H7C9 |
AB2C7D9 |
-103.17 |
4.06 |
-9.53 |
-0.8 |
0 |
|
|
336736 |
127255743 |
1 |
ClO2H7C9 |
AB2C7D9 |
-70.67 |
2.78 |
-9.74 |
-0.84 |
0 |
|
|
336737 |
127255744 |
1 |
IO2H7C9 |
AB2C7D9 |
-43.25 |
3.35 |
-9.38 |
-1.23 |
0 |
|
|
336738 |
127255745 |
1 |
IO2H7C9 |
AB2C7D9 |
-51.13 |
2.42 |
-9.35 |
-1.09 |
0 |
|
|
336739 |
127255746 |
1 |
IO2H7C9 |
AB2C7D9 |
-43.14 |
2.87 |
-9.68 |
-1.27 |
0 |
|
|
336740 |
127255747 |
1 |
IO2H7C9 |
AB2C7D9 |
-45.09 |
4.08 |
-9.45 |
-1.29 |
0 |
|
|
336741 |
127255748 |
1 |
BrO2H7C9 |
AB2C7D9 |
-57.26 |
3.14 |
-9.41 |
-1.05 |
0 |
|
|
336742 |
127255749 |
1 |
BrO2H7C9 |
AB2C7D9 |
-57.96 |
2.75 |
-9.75 |
-0.89 |
0 |
|
|
336743 |
127255750 |
1 |
NO2C9H9 |
AB2C9D9 |
-61.97 |
2.54 |
-8.67 |
-0.59 |
0 |
|
|
336744 |
127255751 |
1 |
NO2C9H9 |
AB2C9D9 |
-74.49 |
2.62 |
-8.92 |
-0.17 |
0 |
|
|
336745 |
127255752 |
1 |
NO4H7C9 |
AB4C7D9 |
-60.61 |
7.47 |
-10.06 |
-1.77 |
0 |
|
|
336746 |
127255753 |
1 |
NO4H7C9 |
AB4C7D9 |
-61.01 |
8.95 |
-10.13 |
-1.3 |
0 |
|
|
336747 |
127255754 |
1 |
NO4H9C10 |
AB4C9D10 |
-58.28 |
7.08 |
-9.76 |
-1.64 |
0 |
|
|
336748 |
127255755 |
1 |
BrO2H9C10 |
AB2C9D10 |
-54.5 |
3.11 |
-9.21 |
-0.76 |
0 |
|
|
336749 |
127255756 |
1 |
NO2C10H11 |
AB2C10D11 |
-57.91 |
5.08 |
-8.45 |
-0.46 |
0 |
|
|
336750 |
127255757 |
1 |
NO2C10H11 |
AB2C10D11 |
-70.54 |
3.28 |
-8.75 |
-0.04 |
0 |
|
|
336751 |
127255758 |
1 |
IOH9C10 |
ABC9D10 |
-11.01 |
3.2 |
-9.59 |
-1.04 |
0 |
|
|
336752 |
127255759 |
1 |
IOH9C10 |
ABC9D10 |
-10.27 |
2.25 |
-9.49 |
-1.05 |
0 |
|
|
336753 |
127255760 |
1 |
IOH9C10 |
ABC9D10 |
-12.88 |
1.6 |
-9.42 |
-0.99 |
0 |
|
|
336754 |
127255761 |
1 |
IOH9C10 |
ABC9D10 |
-9.17 |
2.27 |
-9.5 |
-1.03 |
0 |
|
|
336755 |
127255762 |
1 |
IOH9C10 |
ABC9D10 |
-11.46 |
1.79 |
-9.64 |
-1.07 |
0 |
|
|
336756 |
127255763 |
1 |
IOH9C10 |
ABC9D10 |
-10.88 |
3.18 |
-9.37 |
-0.92 |
0 |
|
|
336757 |
127255764 |
1 |
I2O2H8C9 |
A2B2C8D9 |
-39.38 |
3.81 |
-9.67 |
-1.39 |
0 |
|
|
336758 |
127255765 |
1 |
I2O2H8C9 |
A2B2C8D9 |
-39.44 |
4.32 |
-9.64 |
-1.46 |
0 |
|
|
336759 |
127255766 |
1 |
I2O2H8C9 |
A2B2C8D9 |
-39.0 |
3.19 |
-9.76 |
-1.42 |
0 |
|
|
336760 |
127255767 |
1 |
I2O2H8C9 |
A2B2C8D9 |
-37.7 |
2.68 |
-9.53 |
-1.45 |
0 |
|
|
336761 |
127255768 |
1 |
ClIO2H8C9 |
ABC2D8E9 |
-61.69 |
4.77 |
-9.73 |
-1.3 |
0 |
|
|
336762 |
127255769 |
1 |
ClIO2H8C9 |
ABC2D8E9 |
-65.4 |
3.98 |
-9.7 |
-1.27 |
0 |
|
|
336763 |
127255770 |
1 |
ClIO2H8C9 |
ABC2D8E9 |
-65.57 |
4.43 |
-9.65 |
-1.27 |
0 |
|
|
336764 |
127255771 |
1 |
ClIO2H8C9 |
ABC2D8E9 |
-61.95 |
2.65 |
-9.62 |
-1.25 |
0 |
|
|
336765 |
127255772 |
1 |
ClIO2H8C9 |
ABC2D8E9 |
-65.25 |
3.01 |
-9.81 |
-1.29 |
0 |
|
|
336766 |
127255773 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-101.48 |
4.36 |
-9.74 |
-1.25 |
0 |
|
|
336767 |
127255774 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-102.6 |
4.37 |
-9.7 |
-1.23 |
0 |
|
|
336768 |
127255775 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-102.69 |
2.67 |
-9.63 |
-1.2 |
0 |
|
|
336769 |
127255776 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-103.34 |
3.02 |
-9.84 |
-1.28 |
0 |
|
|
336770 |
127255777 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-101.98 |
2.54 |
-9.72 |
-1.27 |
0 |
|
|
336771 |
127255778 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-51.05 |
4.73 |
-9.78 |
-1.34 |
0 |
|
|
336772 |
127255779 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-50.98 |
4.53 |
-9.82 |
-1.37 |
0 |
|
|
336773 |
127255780 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-53.82 |
4.24 |
-9.74 |
-1.36 |
0 |
|
|
336774 |
127255781 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-53.22 |
3.05 |
-9.82 |
-1.31 |
0 |
|
|
336775 |
127255782 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-51.3 |
2.64 |
-9.67 |
-1.3 |
0 |
|
|
336776 |
127255783 |
1 |
IO2C10H11 |
AB2C10D11 |
-64.52 |
3.68 |
-9.51 |
-0.93 |
0 |
|
|
336777 |
127255784 |
1 |
IO2C10H11 |
AB2C10D11 |
-65.13 |
2.54 |
-9.36 |
-0.93 |
0 |
|
|
336778 |
127255785 |
1 |
IO2C10H11 |
AB2C10D11 |
-66.46 |
3.39 |
-9.4 |
-0.9 |
0 |
|
|
336779 |
127255786 |
1 |
IO2C10H11 |
AB2C10D11 |
-66.69 |
4.03 |
-9.54 |
-0.97 |
0 |
|
|
336780 |
127255787 |
1 |
IO2C10H11 |
AB2C10D11 |
-65.5 |
4.42 |
-9.44 |
-0.96 |
0 |
|
|
336781 |
127255788 |
1 |
IO3C9H9 |
AB3C9D9 |
-101.64 |
3.68 |
-9.4 |
-1.25 |
0 |
|
|
336782 |
127255789 |
1 |
IO3C9H9 |
AB3C9D9 |
-102.13 |
3.98 |
-9.34 |
-1.08 |
0 |
|
|
336783 |
127255790 |
1 |
IO3C9H9 |
AB3C9D9 |
-103.19 |
4.18 |
-9.41 |
-1.25 |
0 |
|
|
336784 |
127255791 |
2 |
BrN2C3H3 |
AB2C3D3 |
27.64 |
1.98 |
-8.62 |
-0.43 |
0 |
|
|
336785 |
127255792 |
1 |
NaSN2O2C3H9 |
ABC2D2E3F9 |
-101.94 |
9.71 |
-8.36 |
0.7 |
0 |
|
|
336786 |
127255793 |
1 |
NO3C13H15 |
AB3C13D15 |
-114.34 |
2.92 |
-9.58 |
-0.01 |
0 |
|
|
336787 |
127255794 |
1 |
ClN2F4H5C6 |
AB2C4D5E6 |
-192.85 |
4.22 |
-10.13 |
-1.29 |
0 |
|
|
336788 |
127255795 |
1 |
FeC4O8H14 |
AB4C8D14 |
-423.39 |
3.79 |
-9.31 |
-0.33 |
0 |
|
|
336789 |
127255796 |
1 |
BrClF2H4C7 |
ABC2D4E7 |
-79.64 |
2.81 |
-9.98 |
-1.19 |
0 |
|
|
336790 |
127255797 |
1 |
Cl2F2H4C7 |
A2B2C4D7 |
-89.46 |
2.34 |
-10.09 |
-0.97 |
0 |
|
|
336791 |
127255798 |
1 |
Br2F3H5C8 |
A2B3C5D8 |
-132.69 |
3.03 |
-10.16 |
-1.08 |
0 |
|
|
336792 |
127255799 |
1 |
BrClF2H4C7 |
ABC2D4E7 |
-79.0 |
2.49 |
-9.88 |
-1.21 |
0 |
|
|
336793 |
127255800 |
1 |
Cl2F2H4C7 |
A2B2C4D7 |
-88.96 |
2.42 |
-9.96 |
-1.04 |
0 |
|
|
336794 |
127255801 |
1 |
NO6C14H23 |
AB6C14D23 |
-279.16 |
2.71 |
-10.04 |
-0.06 |
0 |
|
|
336795 |
127255802 |
1 |
PN5O6C18H22 |
AB5C6D18E22 |
-203.4 |
8.85 |
-9.31 |
-0.82 |
0 |
|
|
336796 |
127255803 |
1 |
PN5O6C20H26 |
AB5C6D20E26 |
-222.19 |
7.22 |
-9.2 |
-0.71 |
0 |
|
|
336797 |
127255804 |
1 |
FNOC10H12 |
ABCD10E12 |
-77.81 |
4.66 |
-9.02 |
-0.04 |
0 |
|
|
336798 |
127255805 |
1 |
FNOC10H12 |
ABCD10E12 |
-78.52 |
2.23 |
-9.15 |
-0.17 |
0 |
|
|
336799 |
127255806 |
1 |
FNOC9H10 |
ABCD9E10 |
-71.94 |
0.82 |
-9.25 |
-0.19 |
0 |
|
|
336800 |
127255807 |
1 |
OCl2N2F3C6H7 |
AB2C2D3E6F7 |
-247.17 |
2.52 |
-9.9 |
-0.95 |
0 |