List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
143737 |
53253231 |
1 |
ON3C23H23 |
AB3C23D23 |
24.1 |
7.11 |
-8.32 |
-0.54 |
0 |
|
|
143738 |
53253232 |
1 |
O2N3C23H23 |
A2B3C23D23 |
-15.85 |
2.12 |
-8.35 |
-0.68 |
0 |
|
|
143739 |
53253233 |
1 |
O2N3H21C24 |
A2B3C21D24 |
-2.6 |
2.19 |
-8.5 |
-0.96 |
0 |
|
|
143740 |
53253234 |
1 |
FN7C21H24 |
AB7C21D24 |
58.52 |
7.46 |
-9.03 |
-1.06 |
0 |
|
|
143741 |
53253235 |
1 |
FON7C18H20 |
ABC7D18E20 |
3.17 |
6.08 |
-9.11 |
-1.14 |
0 |
|
|
143742 |
53253236 |
1 |
ON6C16H16 |
AB6C16D16 |
78.19 |
6.49 |
-9.11 |
-1.29 |
0 |
|
|
143743 |
53253237 |
1 |
N6C19H20 |
A6B19C20 |
105.41 |
5.01 |
-9.08 |
-1.35 |
0 |
|
|
143744 |
53253238 |
1 |
SF2O4N5H15C22 |
AB2C4D5E15F22 |
-153.42 |
5.17 |
-8.9 |
-1.74 |
0 |
|
|
143745 |
53253414 |
1 |
ClO2H15C17 |
AB2C15D17 |
-43.8 |
1.75 |
-9.16 |
-0.86 |
0 |
|
|
143746 |
53253415 |
1 |
FO2H13C16 |
AB2C13D16 |
-71.16 |
1.87 |
-9.17 |
-0.96 |
0 |
|
|
143747 |
53253824 |
1 |
ClFN2O2H18C19 |
ABC2D2E18F19 |
-112.32 |
5.26 |
-9.18 |
-1.21 |
0 |
|
|
143748 |
53253967 |
1 |
S2Si4O7C49H94 |
A2B4C7D49E94 |
-554.25 |
7.17 |
-8.49 |
-0.89 |
0 |
|
|
143749 |
53254434 |
1 |
N2O5C13H14 |
A2B5C13D14 |
-37.57 |
5.73 |
-9.96 |
-1.48 |
0 |
|
|
143750 |
53254435 |
1 |
N2F3O7C20H25 |
A2B3C7D20E25 |
-444.35 |
3.16 |
-9.36 |
-1.12 |
0 |
|
|
143751 |
53254436 |
1 |
N2O7C20H28 |
A2B7C20D28 |
-283.05 |
2.38 |
-8.87 |
-0.85 |
0 |
|
|
143752 |
53254437 |
2 |
NO3C10H14 |
AB3C10D14 |
-253.32 |
3.33 |
-9.03 |
-0.78 |
0 |
|
|
143753 |
53254438 |
1 |
ClN2O6C19H25 |
AB2C6D19E25 |
-250.86 |
1.71 |
-9.33 |
-1.01 |
0 |
|
|
143754 |
53254439 |
2 |
NOC5H6 |
ABC5D6 |
-35.83 |
2.7 |
-8.94 |
-0.35 |
0 |
|
|
143755 |
53254497 |
1 |
BrO4C12H13 |
AB4C12D13 |
-151.15 |
3.4 |
-8.53 |
-1.01 |
0 |
|
|
143757 |
53254776 |
1 |
NO3C17H19 |
AB3C17D19 |
-85.48 |
3.49 |
-8.43 |
-0.23 |
0 |
|
|
143758 |
53255867 |
1 |
N2O5C18H24 |
A2B5C18D24 |
-223.96 |
4.0 |
-9.79 |
-1.2 |
0 |
|
|
143759 |
53256880 |
1 |
OCl2N2C12H16 |
AB2C2D12E16 |
-72.66 |
1.97 |
-9.27 |
-0.64 |
0 |
|
|
143760 |
53257023 |
1 |
ClOSN3H14C21 |
ABCD3E14F21 |
97.15 |
3.59 |
-9.04 |
-1.4 |
0 |
|
|
143761 |
53257061 |
1 |
SN3F4O5H15C20 |
AB3C4D5E15F20 |
-324.41 |
8.44 |
-9.15 |
-1.24 |
0 |
|
|
143762 |
53257062 |
1 |
SF3N3O6H18C21 |
AB3C3D6E18F21 |
-310.63 |
10.93 |
-8.96 |
-1.02 |
0 |
|
|
143763 |
53257063 |
1 |
SF3N3O6H22C27 |
AB3C3D6E22F27 |
-295.64 |
9.48 |
-9.02 |
-1.17 |
0 |
|
|
143764 |
53257127 |
1 |
SN4F6C20H20 |
AB4C6D20E20 |
-264.34 |
5.25 |
-8.71 |
-1.29 |
0 |
|
|
143765 |
53257153 |
1 |
OSCl2N4C17H18 |
ABC2D4E17F18 |
22.82 |
3.87 |
-8.5 |
-0.58 |
0 |
|
|
143767 |
53257582 |
1 |
ON8C18H22 |
AB8C18D22 |
66.51 |
2.5 |
-8.44 |
-0.7 |
0 |
|
|
143768 |
53257942 |
2 |
ON6C23H25 |
AB6C23D25 |
93.96 |
7.77 |
-8.5 |
-0.58 |
0 |
|
|
143769 |
53258000 |
1 |
FO4N5H22C26 |
AB4C5D22E26 |
-28.72 |
2.61 |
-9.36 |
-1.41 |
0 |
|
|
143770 |
53258581 |
1 |
O2N5H13C15 |
A2B5C13D15 |
46.74 |
5.88 |
-9.16 |
-1.41 |
0 |
|
|
143771 |
53259166 |
1 |
NOSSiC26H33 |
ABCDE26F33 |
-21.21 |
7.35 |
-8.54 |
-0.62 |
0 |
|
|
143772 |
53259167 |
1 |
NOPSSiC38H42 |
ABCDEF38G42 |
25.45 |
6.1 |
-8.24 |
-0.56 |
0 |
|
|
143773 |
53259328 |
1 |
O7C23H30 |
A7B23C30 |
-254.11 |
6.05 |
-9.07 |
-0.49 |
0 |
|
|
143774 |
53259446 |
1 |
O2N5H25C28 |
A2B5C25D28 |
34.72 |
2.09 |
-9.0 |
-1.26 |
0 |
|
|
143775 |
53259504 |
1 |
NOC16H23 |
ABC16D23 |
-8.58 |
0.77 |
-8.53 |
0.36 |
0 |
|
|
143776 |
53260213 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-146.48 |
7.17 |
-8.34 |
-0.61 |
0 |
|
|
143777 |
53260769 |
1 |
FN3O3H20C23 |
AB3C3D20E23 |
-93.67 |
3.15 |
-9.16 |
-1.52 |
0 |
|
|
143778 |
53260770 |
1 |
ClO2N4H21C23 |
AB2C4D21E23 |
-14.6 |
7.77 |
-9.17 |
-1.37 |
0 |
|
|
143779 |
53260771 |
2 |
ON2C12H12 |
AB2C12D12 |
-16.79 |
4.75 |
-9.08 |
-1.31 |
0 |
|
|
143780 |
53260772 |
1 |
O2N6H26C27 |
A2B6C26D27 |
31.11 |
5.82 |
-8.65 |
-1.26 |
0 |
|
|
143781 |
53260773 |
1 |
OF4N6C20H20 |
AB4C6D20E20 |
-173.53 |
5.12 |
-9.15 |
-1.21 |
0 |
|
|
143782 |
53260774 |
1 |
FO2N6C22H27 |
AB2C6D22E27 |
-64.65 |
6.54 |
-8.97 |
-0.96 |
0 |
|
|
143783 |
53260775 |
1 |
FON6C23H27 |
ABC6D23E27 |
-4.31 |
7.99 |
-8.9 |
-0.91 |
0 |
|
|
143784 |
53260776 |
1 |
FON6C23H27 |
ABC6D23E27 |
-21.79 |
4.43 |
-9.08 |
-1.13 |
0 |
|
|
143785 |
53260859 |
1 |
NO3C15H19 |
AB3C15D19 |
-45.24 |
2.75 |
-9.49 |
-0.38 |
0 |
|
|
143786 |
53260864 |
1 |
N3O5C23H29 |
A3B5C23D29 |
-131.94 |
7.16 |
-9.42 |
-0.46 |
0 |
|
|
143787 |
53261799 |
1 |
N5C27H27 |
A5B27C27 |
118.94 |
1.92 |
-8.46 |
-0.82 |
0 |
|
|
143788 |
53263020 |
1 |
ClN2O3H11C12 |
AB2C3D11E12 |
-72.8 |
3.02 |
-9.02 |
-0.67 |
0 |