List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
402857 |
135057577 |
1 |
OSC12H16 |
ABC12D16 |
-28.58 |
4.56 |
-9.29 |
-0.78 |
0 |
|
|
402858 |
135057581 |
1 |
BrNO3C21H22 |
ABC3D21E22 |
-99.56 |
2.83 |
-8.88 |
-0.69 |
0 |
|
|
402859 |
135057584 |
1 |
BrNSO4C14H18 |
ABCD4E14F18 |
-165.11 |
4.52 |
-10.25 |
-0.95 |
0 |
|
|
402860 |
135057586 |
1 |
N2O3C23H24 |
A2B3C23D24 |
-86.35 |
3.82 |
-8.7 |
-0.82 |
0 |
|
|
402861 |
135057589 |
1 |
SN2O4C29H30 |
AB2C4D29E30 |
-106.44 |
6.46 |
-8.46 |
-0.7 |
0 |
|
|
402862 |
135057590 |
1 |
NOF3H12C16 |
ABC3D12E16 |
-141.75 |
6.8 |
-8.76 |
-0.68 |
0 |
|
|
402863 |
135057593 |
1 |
NSO3H17C24 |
ABC3D17E24 |
-33.99 |
5.53 |
-8.6 |
-1.03 |
0 |
|
|
402864 |
135057594 |
1 |
NS2O3H15C19 |
AB2C3D15E19 |
-58.15 |
6.03 |
-8.74 |
-1.13 |
0 |
|
|
402865 |
135057596 |
2 |
NOH7C8 |
ABC7D8 |
-36.44 |
4.95 |
-9.83 |
-0.9 |
0 |
|
|
402866 |
135057599 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-30.31 |
3.73 |
-9.35 |
-0.77 |
0 |
|
|
402867 |
135057601 |
1 |
ClNO2C12H16 |
ABC2D12E16 |
-80.34 |
1.57 |
-8.96 |
-0.73 |
0 |
|
|
402868 |
135057602 |
1 |
NO2F3C13H16 |
AB2C3D13E16 |
-234.49 |
3.46 |
-9.11 |
-0.93 |
0 |
|
|
402869 |
135057604 |
1 |
NO2H11C12 |
AB2C11D12 |
-13.33 |
6.34 |
-9.57 |
-0.6 |
0 |
|
|
402870 |
135057605 |
1 |
SN2O2C13H18 |
AB2C2D13E18 |
-44.6 |
5.63 |
-9.62 |
-0.1 |
0 |
|
|
402871 |
135057608 |
1 |
NSO4H17C21 |
ABC4D17E21 |
-94.34 |
5.84 |
-8.76 |
-0.74 |
0 |
|
|
402872 |
135057611 |
1 |
NCl2O2H11C14 |
AB2C2D11E14 |
-49.05 |
2.5 |
-9.85 |
-1.21 |
0 |
|
|
402873 |
135057614 |
1 |
BClNO3C15H21 |
ABCD3E15F21 |
-226.07 |
5.79 |
-9.02 |
-0.37 |
0 |
|
|
402874 |
135057616 |
1 |
BBrNO3C15H21 |
ABCD3E15F21 |
-216.0 |
6.55 |
-8.87 |
-0.42 |
0 |
|
|
402875 |
135057622 |
1 |
NO2H15C17 |
AB2C15D17 |
1.93 |
4.98 |
-8.83 |
-0.71 |
0 |
|
|
402876 |
135057626 |
1 |
ON3H13C20 |
AB3C13D20 |
124.58 |
3.58 |
-9.33 |
-1.24 |
-1 |
|
|
402877 |
135057629 |
1 |
BBrNO3C15H20 |
ABCD3E15F20 |
-180.61 |
0.84 |
0.0 |
0.0 |
0 |
|
|
402878 |
135057630 |
1 |
ON2H14C20 |
AB2C14D20 |
82.82 |
2.91 |
-8.87 |
-0.86 |
0 |
|
|
402879 |
135057649 |
1 |
ClFO3N4H12C21 |
ABC3D4E12F21 |
60.12 |
2.38 |
-9.52 |
-2.31 |
0 |
|
|
402880 |
135057656 |
1 |
Cl2O2N7C26H27 |
A2B2C7D26E27 |
51.76 |
2.7 |
-8.42 |
-1.38 |
0 |
|
|
402881 |
135057657 |
2 |
N2O2C11H12 |
A2B2C11D12 |
-77.98 |
7.65 |
-8.75 |
-0.4 |
0 |
|
|
402882 |
135057668 |
1 |
SiO2C21H24 |
AB2C21D24 |
-49.57 |
2.33 |
-9.11 |
0.22 |
0 |
|
|
402883 |
135057670 |
1 |
N2S2C27H44 |
A2B2C27D44 |
-27.39 |
1.66 |
-8.05 |
0.15 |
0 |
|
|
402884 |
135057694 |
1 |
FNO3C13H14 |
ABC3D13E14 |
-142.2 |
2.4 |
-9.57 |
-0.78 |
0 |
|
|
402885 |
135057695 |
1 |
NO3C17H23 |
AB3C17D23 |
-120.09 |
1.71 |
-9.26 |
-0.39 |
0 |
|
|
402886 |
135057701 |
1 |
NO3C15H17 |
AB3C15D17 |
-110.25 |
2.66 |
-8.89 |
-0.42 |
0 |
|
|
402887 |
135057702 |
1 |
NO3C16H19 |
AB3C16D19 |
-119.56 |
3.11 |
-8.72 |
-0.43 |
0 |
|
|
402888 |
135057714 |
1 |
ON2H14C16 |
AB2C14D16 |
10.22 |
6.79 |
-9.13 |
-0.74 |
0 |
|
|
402889 |
135057717 |
1 |
FN2O3H13C18 |
AB2C3D13E18 |
-94.26 |
4.06 |
-8.83 |
-1.37 |
0 |
|
|
402890 |
135057720 |
1 |
SN2O6C12H22 |
AB2C6D12E22 |
-289.44 |
3.69 |
-10.12 |
-0.59 |
0 |
|
|
402891 |
135057724 |
1 |
NSO3H17C21 |
ABC3D17E21 |
-62.93 |
5.8 |
-8.72 |
-0.81 |
0 |
|
|
402893 |
135057733 |
1 |
NO2H13C15 |
AB2C13D15 |
-7.02 |
3.09 |
-8.64 |
-0.79 |
0 |
|
|
402894 |
135057734 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-140.5 |
4.26 |
-8.69 |
0.06 |
0 |
|
|
402895 |
135057735 |
1 |
N2O3C18H20 |
A2B3C18D20 |
-104.14 |
3.92 |
-8.74 |
-0.51 |
0 |
|
|
402896 |
135057736 |
1 |
N2O3F7H15C19 |
A2B3C7D15E19 |
-401.52 |
9.71 |
-9.07 |
-1.5 |
0 |
|
|
402897 |
135057739 |
1 |
NO4C21H23 |
AB4C21D23 |
-101.63 |
1.82 |
-8.83 |
-0.95 |
0 |
|
|
402898 |
135057741 |
1 |
NSO3C10H19 |
ABC3D10E19 |
-143.38 |
6.24 |
-9.74 |
-0.14 |
0 |
|
|
402899 |
135057742 |
1 |
N2C13H16 |
A2B13C16 |
35.23 |
2.97 |
-9.82 |
-0.3 |
0 |
|
|
402900 |
135057743 |
1 |
NO3C15H19 |
AB3C15D19 |
-94.51 |
2.3 |
-9.51 |
-0.88 |
0 |
|
|
402901 |
135057745 |
1 |
SiO2C11H18 |
AB2C11D18 |
-108.12 |
1.42 |
-8.62 |
0.12 |
0 |
|
|
402902 |
135057764 |
1 |
OCl2N3H9C15 |
AB2C3D9E15 |
64.72 |
3.13 |
-9.53 |
-1.15 |
0 |
|
|
402903 |
135057769 |
2 |
ON2C10H10 |
AB2C10D10 |
56.61 |
6.16 |
-9.28 |
-1.52 |
0 |
|
|
402904 |
135057770 |
1 |
ClN2O2C11H11 |
AB2C2D11E11 |
-55.31 |
2.31 |
-8.95 |
-0.89 |
0 |
|
|
402905 |
135057797 |
1 |
NO3S3Cl6H15C23 |
AB3C3D6E15F23 |
-34.94 |
2.32 |
-9.2 |
-1.59 |
0 |
|
|
402906 |
135057805 |
1 |
O4C15H18 |
A4B15C18 |
-157.42 |
2.72 |
-8.6 |
-0.24 |
0 |
|
|
402907 |
135057826 |
1 |
NO3H23C29 |
AB3C23D29 |
-9.25 |
5.54 |
-8.53 |
-0.43 |
0 |