List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
365042 |
127316692 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-94.36 |
2.57 |
-8.85 |
0.54 |
0 |
|
|
365043 |
127316703 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-10.72 |
6.72 |
-9.02 |
-1.07 |
0 |
|
|
365044 |
127316704 |
1 |
O2N3C17H29 |
A2B3C17D29 |
-116.85 |
0.9 |
-8.69 |
0.88 |
0 |
|
|
365045 |
127316724 |
1 |
OF2N2C15H18 |
AB2C2D15E18 |
-112.8 |
4.83 |
-8.9 |
-0.7 |
0 |
|
|
365046 |
127316725 |
1 |
ON2C16H22 |
AB2C16D22 |
-31.37 |
4.6 |
-8.73 |
0.0 |
0 |
|
|
365047 |
127316726 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-149.74 |
5.56 |
-8.73 |
0.01 |
0 |
|
|
365048 |
127316727 |
1 |
ON2C14H24 |
AB2C14D24 |
-65.25 |
3.94 |
-8.72 |
1.29 |
0 |
|
|
365049 |
127316728 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-94.37 |
2.58 |
-8.86 |
0.54 |
0 |
|
|
365050 |
127316729 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-123.54 |
7.68 |
-8.89 |
-0.41 |
0 |
|
|
365051 |
127316732 |
1 |
BrON4C18H21 |
ABC4D18E21 |
26.27 |
4.27 |
-8.88 |
-0.34 |
0 |
|
|
365052 |
127316733 |
1 |
ON3C16H23 |
AB3C16D23 |
-33.41 |
4.77 |
-8.79 |
-0.23 |
0 |
|
|
365053 |
127316734 |
3 |
NOC6H9 |
ABC6D9 |
-142.59 |
5.15 |
-8.6 |
-0.04 |
0 |
|
|
365054 |
127316735 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-29.93 |
5.47 |
-8.82 |
-0.16 |
0 |
|
|
365055 |
127316736 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-83.3 |
2.2 |
-8.81 |
-0.38 |
0 |
|
|
365056 |
127316737 |
1 |
O2F3N4C18H19 |
A2B3C4D18E19 |
-140.53 |
4.62 |
-8.9 |
-1.56 |
0 |
|
|
365057 |
127316738 |
1 |
ON4C14H22 |
AB4C14D22 |
-13.92 |
5.28 |
-8.66 |
0.32 |
0 |
|
|
365058 |
127316739 |
1 |
OSN2C14H24 |
ABC2D14E24 |
-61.16 |
4.82 |
-8.35 |
0.98 |
0 |
|
|
365059 |
127316740 |
1 |
ON2C15H26 |
AB2C15D26 |
-69.51 |
3.97 |
-8.69 |
1.32 |
0 |
|
|
365060 |
127316774 |
1 |
ON3C13H19 |
AB3C13D19 |
-20.68 |
4.88 |
-8.57 |
0.58 |
0 |
|
|
365061 |
127316775 |
1 |
ON4C16H26 |
AB4C16D26 |
-24.54 |
4.41 |
-8.64 |
0.47 |
0 |
|
|
365062 |
127316776 |
1 |
SN3O3C17H31 |
AB3C3D17E31 |
-153.56 |
5.12 |
-8.75 |
0.19 |
0 |
|
|
365063 |
127316777 |
1 |
OF4N5C18H19 |
AB4C5D18E19 |
-157.09 |
3.56 |
-8.82 |
-1.32 |
0 |
|
|
365064 |
127316778 |
1 |
ON3C14H21 |
AB3C14D21 |
-30.47 |
4.92 |
-8.58 |
0.6 |
0 |
|
|
365065 |
127316779 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-90.68 |
4.61 |
-8.64 |
-1.27 |
0 |
|
|
365066 |
127316780 |
1 |
O2F3N3C15H22 |
A2B3C3D15E22 |
-257.78 |
6.31 |
-8.97 |
0.5 |
0 |
|
|
365067 |
127316781 |
1 |
OF2N2C15H18 |
AB2C2D15E18 |
-115.31 |
4.87 |
-8.76 |
-0.7 |
0 |
|
|
365068 |
127316782 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-181.15 |
8.41 |
-9.06 |
0.54 |
0 |
|
|
365069 |
127316783 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-27.49 |
7.53 |
-8.29 |
-0.9 |
0 |
|
|
365070 |
127316784 |
1 |
ON4C14H22 |
AB4C14D22 |
-15.22 |
4.44 |
-8.6 |
0.4 |
0 |
|
|
365071 |
127316785 |
1 |
ON3C15H21 |
AB3C15D21 |
-22.22 |
4.31 |
-8.79 |
-0.44 |
0 |
|
|
365072 |
127316814 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-75.25 |
3.96 |
-8.62 |
0.37 |
0 |
|
|
365073 |
127316815 |
1 |
ON2C15H26 |
AB2C15D26 |
-71.06 |
3.92 |
-8.73 |
1.16 |
0 |
|
|
365074 |
127316816 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-139.23 |
6.38 |
-8.82 |
-0.83 |
0 |
|
|
365075 |
127316817 |
2 |
ON3C8H11 |
AB3C8D11 |
-26.33 |
1.34 |
-8.81 |
-0.73 |
0 |
|
|
365076 |
127316818 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-110.94 |
3.58 |
-8.7 |
-0.64 |
0 |
|
|
365077 |
127316819 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-62.6 |
3.79 |
-8.81 |
-1.08 |
0 |
|
|
365078 |
127316820 |
1 |
ClON3C14H20 |
ABC3D14E20 |
-30.48 |
4.32 |
-8.8 |
0.13 |
0 |
|
|
365079 |
127316821 |
1 |
ON4C13H20 |
AB4C13D20 |
-3.47 |
5.68 |
-8.7 |
0.26 |
0 |
|
|
365080 |
127316822 |
1 |
SO2N4C19H24 |
AB2C4D19E24 |
-61.24 |
5.63 |
-8.64 |
-1.11 |
0 |
|
|
365081 |
127316823 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-97.97 |
0.28 |
-8.72 |
0.66 |
0 |
|
|
365082 |
127316824 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-143.82 |
3.54 |
-8.65 |
0.02 |
0 |
|
|
365083 |
127316825 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-71.22 |
4.5 |
-8.87 |
-1.02 |
0 |
|
|
365084 |
127316826 |
1 |
O2N6C17H22 |
A2B6C17D22 |
-1.29 |
3.81 |
-8.75 |
-1.36 |
0 |
|
|
365085 |
127316827 |
1 |
ClOSN2C13H17 |
ABCD2E13F17 |
-18.89 |
4.15 |
-8.81 |
-0.87 |
0 |
|
|
365086 |
127316828 |
1 |
ON2C15H26 |
AB2C15D26 |
-71.22 |
3.7 |
-8.67 |
1.31 |
0 |
|
|
365087 |
127316829 |
1 |
OSN6C15H24 |
ABC6D15E24 |
43.09 |
7.48 |
-8.99 |
-0.7 |
0 |
|
|
365088 |
127316830 |
1 |
ON6C20H28 |
AB6C20D28 |
44.03 |
3.18 |
-8.92 |
-0.58 |
0 |
|
|
365089 |
127316831 |
1 |
OCl2N5C18H21 |
AB2C5D18E21 |
18.48 |
6.16 |
-8.57 |
-1.13 |
0 |
|
|
365090 |
127316832 |
1 |
O2N3C22H23 |
A2B3C22D23 |
2.49 |
5.56 |
-8.94 |
-0.9 |
0 |
|
|
365091 |
127316833 |
1 |
ON4C16H20 |
AB4C16D20 |
6.11 |
3.93 |
-8.72 |
-0.52 |
0 |