List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
414845 |
135087817 |
1 |
N2O5C17H30 |
A2B5C17D30 |
-248.41 |
5.58 |
-8.72 |
1.1 |
0 |
|
|
414847 |
135087819 |
1 |
N3O3C24H35 |
A3B3C24D35 |
-134.05 |
4.96 |
-9.21 |
-0.01 |
0 |
|
|
414848 |
135087820 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-75.71 |
6.25 |
-8.71 |
-0.15 |
0 |
|
|
414849 |
135087821 |
1 |
N2O3C18H26 |
A2B3C18D26 |
-112.46 |
3.58 |
-9.03 |
-0.31 |
0 |
|
|
414850 |
135087822 |
1 |
SO2N4C15H24 |
AB2C4D15E24 |
-55.35 |
0.93 |
-8.98 |
0.05 |
0 |
|
|
414851 |
135087823 |
1 |
ClN5O5C30H36 |
AB5C5D30E36 |
-78.67 |
8.91 |
-8.44 |
-1.1 |
0 |
|
|
414852 |
135087824 |
1 |
ClN2S2O4C14H19 |
AB2C2D4E14F19 |
-146.0 |
5.6 |
-9.69 |
-1.34 |
0 |
|
|
414853 |
135087825 |
1 |
FO2N4H17C19 |
AB2C4D17E19 |
-39.13 |
5.88 |
-9.42 |
-1.09 |
0 |
|
|
414854 |
135087826 |
1 |
ON4C22H26 |
AB4C22D26 |
12.13 |
2.71 |
-9.29 |
-0.64 |
0 |
|
|
414855 |
135087827 |
1 |
ON4C20H24 |
AB4C20D24 |
23.37 |
4.91 |
-8.55 |
-0.59 |
0 |
|
|
414856 |
135087828 |
2 |
ON2C8H14 |
AB2C8D14 |
-100.03 |
4.19 |
-9.15 |
0.56 |
0 |
|
|
414857 |
135087829 |
1 |
ON5C13H17 |
AB5C13D17 |
83.01 |
3.51 |
-8.61 |
-0.31 |
0 |
|
|
414858 |
135087830 |
1 |
N3O5C20H25 |
A3B5C20D25 |
-129.33 |
0.8 |
-8.99 |
-0.76 |
0 |
|
|
414859 |
135087831 |
1 |
O5N6C23H32 |
A5B6C23D32 |
-153.75 |
5.35 |
-9.36 |
-0.25 |
0 |
|
|
414860 |
135087832 |
1 |
N2O2C21H32 |
A2B2C21D32 |
-94.37 |
3.16 |
-9.09 |
0.28 |
0 |
|
|
414861 |
135087833 |
2 |
ON2C10H13 |
AB2C10D13 |
-31.8 |
2.66 |
-9.09 |
-0.15 |
0 |
|
|
414862 |
135087834 |
1 |
O3N6C17H22 |
A3B6C17D22 |
-65.12 |
3.98 |
-8.31 |
-0.11 |
0 |
|
|
414863 |
135087835 |
1 |
SN2O4C18H20 |
AB2C4D18E20 |
-128.96 |
2.49 |
-9.59 |
-1.21 |
0 |
|
|
414864 |
135087836 |
2 |
NOC10H13 |
ABC10D13 |
-64.04 |
4.3 |
-8.56 |
0.18 |
0 |
|
|
414865 |
135087837 |
1 |
ClN6C16H17 |
AB6C16D17 |
80.84 |
3.51 |
-9.14 |
-0.98 |
0 |
|
|
414866 |
135087838 |
2 |
NOC12H14 |
ABC12D14 |
-22.47 |
3.7 |
-8.85 |
-0.72 |
0 |
|
|
414867 |
135087839 |
1 |
OSN3C16H21 |
ABC3D16E21 |
10.55 |
3.66 |
-9.15 |
-0.35 |
0 |
|
|
414869 |
135087841 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-1.07 |
5.87 |
-8.88 |
-0.51 |
0 |
|
|
414870 |
135087842 |
1 |
N2O5C15H20 |
A2B5C15D20 |
-215.34 |
4.08 |
-9.65 |
-0.84 |
0 |
|
|
414871 |
135087843 |
1 |
O7N9C42H55 |
A7B9C42D55 |
-243.08 |
6.67 |
-8.28 |
-0.16 |
0 |
|
|
414872 |
135087844 |
1 |
OSN7C14H15 |
ABC7D14E15 |
87.59 |
7.15 |
-9.65 |
-1.53 |
0 |
|
|
414873 |
135087845 |
1 |
S2O7N8C36H48 |
A2B7C8D36E48 |
-167.02 |
7.57 |
-8.1 |
-1.12 |
0 |
|
|
414874 |
135087846 |
1 |
FN2O4C18H25 |
AB2C4D18E25 |
-206.56 |
8.34 |
-8.86 |
-0.55 |
0 |
|
|
414875 |
135087847 |
1 |
O3N6C18H28 |
A3B6C18D28 |
-101.94 |
6.72 |
-8.76 |
0.21 |
0 |
|
|
414876 |
135087848 |
1 |
FO2N3C15H20 |
AB2C3D15E20 |
-84.19 |
2.31 |
-9.07 |
-0.22 |
0 |
|
|
414877 |
135087849 |
2 |
ON3C11H15 |
AB3C11D15 |
-15.22 |
4.26 |
-8.62 |
-0.15 |
0 |
|
|
414879 |
135087851 |
3 |
NOC5H7 |
ABC5D7 |
-82.0 |
4.95 |
-8.97 |
-0.4 |
0 |
|
|
414880 |
135087852 |
1 |
ON6C20H30 |
AB6C20D30 |
-9.0 |
6.13 |
-8.35 |
0.5 |
0 |
|
|
414882 |
135087854 |
1 |
ON3C24H31 |
AB3C24D31 |
-22.05 |
4.58 |
-9.17 |
-0.71 |
0 |
|
|
414883 |
135087855 |
1 |
ON3C21H27 |
AB3C21D27 |
7.64 |
4.29 |
-7.98 |
0.09 |
0 |
|
|
414884 |
135087856 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-15.04 |
5.76 |
-9.22 |
-0.17 |
0 |
|
|
414885 |
135087857 |
1 |
N3O4C13H17 |
A3B4C13D17 |
-111.18 |
5.23 |
-9.28 |
-0.39 |
0 |
|
|
414886 |
135087858 |
1 |
N6O8C37H48 |
A6B8C37D48 |
-210.57 |
6.57 |
-9.49 |
-0.53 |
0 |
|
|
414887 |
135087859 |
1 |
O3N7C19H23 |
A3B7C19D23 |
3.16 |
3.25 |
-8.57 |
-0.72 |
0 |
|
|
414888 |
135087860 |
2 |
NO2C10H14 |
AB2C10D14 |
-184.69 |
7.85 |
-9.3 |
-0.18 |
0 |
|
|
414890 |
135087862 |
1 |
N4C21H30 |
A4B21C30 |
56.16 |
2.56 |
-8.57 |
-0.3 |
0 |
|
|
414891 |
135087863 |
1 |
O2N5C18H21 |
A2B5C18D21 |
40.23 |
2.85 |
-8.44 |
-0.52 |
0 |
|
|
414893 |
135087865 |
1 |
OSN4C15H22 |
ABC4D15E22 |
3.17 |
5.07 |
-8.71 |
0.09 |
0 |
|
|
414894 |
135087866 |
1 |
ON5C24H27 |
AB5C24D27 |
40.54 |
1.09 |
-9.27 |
-0.87 |
0 |
|
|
414895 |
135087867 |
1 |
FO3N5C17H22 |
AB3C5D17E22 |
-77.41 |
2.1 |
-8.95 |
-0.41 |
0 |
|
|
414896 |
135087868 |
1 |
N3O4C17H23 |
A3B4C17D23 |
-123.89 |
5.29 |
-9.02 |
-0.39 |
0 |
|
|
414897 |
135087869 |
1 |
N3O5C21H31 |
A3B5C21D31 |
-241.83 |
2.35 |
-9.04 |
-0.57 |
0 |
|
|
414898 |
135087870 |
1 |
SO4N8C34H46 |
AB4C8D34E46 |
-89.74 |
7.37 |
-9.21 |
-1.18 |
0 |
|
|
414899 |
135087871 |
1 |
SN3O4C15H23 |
AB3C4D15E23 |
-142.83 |
5.46 |
-9.57 |
-0.14 |
0 |
|
|
414900 |
135087872 |
1 |
SN6O8C35H48 |
AB6C8D35E48 |
-347.42 |
5.1 |
-8.62 |
-0.78 |
0 |