List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
311779 |
126597685 |
1 |
BrFO2N6H18C23 |
ABC2D6E18F23 |
21.19 |
2.72 |
-8.7 |
-0.98 |
0 |
|
|
311780 |
126597686 |
1 |
ClO3N9H18C23 |
AB3C9D18E23 |
81.59 |
3.18 |
-9.18 |
-1.44 |
0 |
|
|
311781 |
126597688 |
1 |
F3O3N8H19C23 |
A3B3C8D19E23 |
-107.9 |
5.46 |
-8.89 |
-1.25 |
0 |
|
|
311782 |
126597689 |
1 |
FO3N6H17C18 |
AB3C6D17E18 |
-50.66 |
5.61 |
-8.6 |
-1.08 |
0 |
|
|
311783 |
126597692 |
3 |
ON2C6H6 |
AB2C6D6 |
-4.66 |
3.02 |
-8.57 |
-1.02 |
0 |
|
|
311784 |
126597693 |
1 |
O2N6C19H20 |
A2B6C19D20 |
24.1 |
4.57 |
-8.51 |
-0.92 |
0 |
|
|
311785 |
126597694 |
1 |
FO2N7H14C19 |
AB2C7D14E19 |
57.19 |
4.17 |
-8.82 |
-1.16 |
0 |
|
|
311786 |
126597695 |
1 |
FO3N6C22H23 |
AB3C6D22E23 |
-58.6 |
1.94 |
-8.63 |
-0.94 |
0 |
|
|
311787 |
126597697 |
1 |
ClO3N7H20C23 |
AB3C7D20E23 |
18.63 |
8.28 |
-8.82 |
-0.94 |
0 |
|
|
311788 |
126597700 |
1 |
O2N7C18H19 |
A2B7C18D19 |
35.85 |
3.63 |
-8.6 |
-0.87 |
0 |
|
|
311789 |
126597702 |
1 |
ClO3N8H23C24 |
AB3C8D23E24 |
32.36 |
3.52 |
-8.82 |
-1.18 |
0 |
|
|
311790 |
126597706 |
1 |
FO2N6C21H21 |
AB2C6D21E21 |
0.76 |
1.65 |
-8.55 |
-0.88 |
0 |
|
|
311791 |
126597709 |
1 |
O3N6C19H20 |
A3B6C19D20 |
-8.02 |
5.5 |
-8.38 |
-0.77 |
0 |
|
|
311792 |
126597712 |
1 |
ClO3N6C21H21 |
AB3C6D21E21 |
-17.9 |
3.13 |
-8.49 |
-0.84 |
0 |
|
|
311793 |
126597713 |
1 |
SO4N6C20H22 |
AB4C6D20E22 |
-62.06 |
6.0 |
-8.69 |
-1.01 |
0 |
|
|
311794 |
126597714 |
1 |
ClO3N7H22C24 |
AB3C7D22E24 |
26.29 |
4.02 |
-8.68 |
-0.94 |
0 |
|
|
311795 |
126597715 |
1 |
O3N7C24H29 |
A3B7C24D29 |
-18.67 |
4.49 |
-8.32 |
-0.82 |
0 |
|
|
311796 |
126597716 |
1 |
Cl2O3N8H24C26 |
A2B3C8D24E26 |
28.8 |
6.58 |
-8.98 |
-1.05 |
0 |
|
|
311797 |
126597717 |
2 |
ON3C10H13 |
AB3C10D13 |
-15.3 |
5.1 |
-8.42 |
-0.42 |
0 |
|
|
311798 |
126597718 |
2 |
ON3C9H9 |
AB3C9D9 |
13.98 |
6.21 |
-8.48 |
-0.92 |
0 |
|
|
311799 |
126597719 |
1 |
FO2N6C21H23 |
AB2C6D21E23 |
-30.41 |
1.94 |
-8.57 |
-0.89 |
0 |
|
|
311800 |
126597720 |
1 |
ClO3N6H15C17 |
AB3C6D15E17 |
-14.44 |
3.08 |
-8.76 |
-1.0 |
0 |
|
|
311802 |
126597722 |
1 |
FO2N7C22H26 |
AB2C7D22E26 |
-25.78 |
2.1 |
-8.5 |
-0.83 |
0 |
|
|
311803 |
126597723 |
1 |
O3F4N6H18C24 |
A3B4C6D18E24 |
-184.91 |
2.74 |
-8.61 |
-0.95 |
0 |
|
|
311804 |
126597724 |
1 |
FO2N6H17C19 |
AB2C6D17E19 |
10.65 |
0.95 |
-8.57 |
-0.91 |
0 |
|
|
311805 |
126597725 |
1 |
ClO3N7H18C21 |
AB3C7D18E21 |
49.28 |
3.24 |
-8.69 |
-1.0 |
0 |
|
|
311806 |
126597727 |
1 |
FO2N7H20C22 |
AB2C7D20E22 |
23.94 |
2.82 |
-8.65 |
-0.98 |
0 |
|
|
311807 |
126597733 |
1 |
O2F4N8H16C21 |
A2B4C8D16E21 |
-133.95 |
3.6 |
-8.76 |
-1.11 |
0 |
|
|
311808 |
126597734 |
1 |
ClO2F3N6H16C19 |
AB2C3D6E16F19 |
-135.87 |
2.59 |
-8.64 |
-0.99 |
0 |
|
|
311809 |
126597739 |
1 |
ClO3N6H17C18 |
AB3C6D17E18 |
-14.91 |
1.93 |
-8.76 |
-1.15 |
0 |
|
|
311810 |
126597742 |
1 |
ClO3N9H22C27 |
AB3C9D22E27 |
74.62 |
5.7 |
-8.91 |
-1.23 |
0 |
|
|
311811 |
126597743 |
1 |
O2N6C17H20 |
A2B6C17D20 |
14.2 |
5.04 |
-8.49 |
-0.44 |
0 |
|
|
311813 |
126597750 |
1 |
ClO2N6H17C18 |
AB2C6D17E18 |
22.87 |
1.61 |
-8.56 |
-0.9 |
0 |
|
|
311814 |
126597751 |
1 |
FO4N7H18C20 |
AB4C7D18E20 |
-76.49 |
3.92 |
-8.84 |
-1.15 |
0 |
|
|
311815 |
126597755 |
1 |
ClO2N6H19C24 |
AB2C6D19E24 |
60.67 |
2.22 |
-8.63 |
-0.98 |
0 |
|
|
311816 |
126597799 |
1 |
FO3N7H16C20 |
AB3C7D16E20 |
-5.58 |
0.97 |
-8.64 |
-0.96 |
0 |
|
|
311818 |
126597828 |
1 |
F2O3N7C24H27 |
A2B3C7D24E27 |
-127.05 |
2.25 |
-8.55 |
-0.99 |
0 |
|
|
311819 |
126597834 |
1 |
SF2O5N6C23H26 |
AB2C5D6E23F26 |
-215.4 |
5.5 |
-8.69 |
-1.13 |
0 |
|
|
311820 |
126597858 |
1 |
ClO3N6H19C20 |
AB3C6D19E20 |
-10.26 |
1.32 |
-8.62 |
-0.95 |
0 |
|
|
311821 |
126597893 |
1 |
ClO2N8H21C22 |
AB2C8D21E22 |
51.12 |
3.45 |
-8.66 |
-0.98 |
0 |
|
|
311822 |
126597900 |
1 |
O3N8H18C21 |
A3B8C18D21 |
49.86 |
2.58 |
-8.87 |
-1.17 |
0 |
|
|
311824 |
126597947 |
1 |
F2O4N7C24H29 |
A2B4C7D24E29 |
-167.37 |
4.55 |
-8.53 |
-0.91 |
0 |
|
|
311827 |
126598035 |
1 |
FCl2N7C24H24 |
AB2C7D24E24 |
60.88 |
3.44 |
-8.7 |
-0.91 |
0 |
|
|
311828 |
126598071 |
1 |
NF3C9H12 |
AB3C9D12 |
-133.36 |
4.24 |
-9.29 |
1.48 |
0 |
|
|
311830 |
126598081 |
1 |
NOF2C9H11 |
ABC2D9E11 |
-108.87 |
2.91 |
-9.84 |
0.22 |
0 |
|
|
311832 |
126598112 |
1 |
O2N6C23H28 |
A2B6C23D28 |
-12.56 |
4.99 |
-9.0 |
-0.35 |
0 |
|
|
311833 |
126598117 |
1 |
S2N3F6O6H35C40 |
A2B3C6D6E35F40 |
-280.3 |
17.62 |
-7.54 |
-3.49 |
0 |
|
|
311834 |
126598129 |
1 |
INH8C9 |
ABC8D9 |
48.69 |
2.97 |
-8.36 |
-2.52 |
0 |
|
|
311835 |
126598190 |
1 |
SN2C8H8 |
AB2C8D8 |
53.69 |
1.18 |
-8.52 |
-0.9 |
0 |
|
|
311836 |
126598191 |
1 |
OPN5C28H38 |
ABC5D28E38 |
-1.36 |
4.22 |
-8.64 |
-0.64 |
0 |