List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
433801 |
135173943 |
1 |
ION2C13H27 |
ABC2D13E27 |
-48.06 |
3.93 |
-8.4 |
-2.48 |
0 |
|
|
433802 |
135173944 |
1 |
INO6C17H26 |
ABC6D17E26 |
-207.3 |
1.85 |
-8.01 |
-1.42 |
0 |
|
|
433803 |
135173945 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-140.21 |
4.47 |
-8.84 |
1.02 |
0 |
|
|
433804 |
135173946 |
2 |
OC8H15 |
AB8C15 |
-154.61 |
2.43 |
-10.2 |
1.14 |
0 |
|
|
433805 |
135173947 |
2 |
O2C6H9 |
A2B6C9 |
-165.76 |
3.07 |
-10.66 |
-0.35 |
0 |
|
|
433806 |
135173948 |
1 |
ON3C10H19 |
AB3C10D19 |
8.0 |
2.56 |
-8.54 |
0.81 |
0 |
|
|
433807 |
135173949 |
1 |
SF3O3N8H21C24 |
AB3C3D8E21F24 |
-145.23 |
9.96 |
-8.85 |
-1.26 |
0 |
|
|
433808 |
135173950 |
1 |
NO2C15H17 |
AB2C15D17 |
-37.57 |
4.36 |
-8.56 |
0.05 |
0 |
|
|
433809 |
135173951 |
1 |
NO2C13H17 |
AB2C13D17 |
-49.94 |
2.2 |
-8.54 |
-0.21 |
0 |
|
|
433810 |
135173952 |
1 |
NO2C17H25 |
AB2C17D25 |
-26.63 |
3.5 |
-8.91 |
-0.19 |
0 |
|
|
433811 |
135173953 |
1 |
OF2N4C14H22 |
AB2C4D14E22 |
-107.06 |
5.65 |
-8.05 |
-0.02 |
0 |
|
|
433812 |
135173954 |
1 |
NO5C17H37 |
AB5C17D37 |
-243.77 |
1.26 |
-8.93 |
1.28 |
0 |
|
|
433813 |
135173955 |
1 |
SF3N6O13C47H47 |
AB3C6D13E47F47 |
-533.45 |
8.07 |
-8.91 |
-1.57 |
0 |
|
|
433814 |
135173956 |
1 |
S2F3N8O10C54H61 |
A2B3C8D10E54F61 |
-440.31 |
4.7 |
-8.67 |
-0.89 |
0 |
|
|
433815 |
135173957 |
1 |
N6O7C36H36 |
A6B7C36D36 |
-148.37 |
10.79 |
-8.96 |
-1.78 |
0 |
|
|
433816 |
135173959 |
1 |
O2N3C13H29 |
A2B3C13D29 |
-94.29 |
3.82 |
-8.74 |
1.42 |
0 |
|
|
433817 |
135173960 |
1 |
N5C14H15 |
A5B14C15 |
128.87 |
4.35 |
-8.5 |
-0.24 |
0 |
|
|
433818 |
135173961 |
1 |
O2N5C22H33 |
A2B5C22D33 |
-23.66 |
4.63 |
-8.01 |
-0.01 |
0 |
|
|
433819 |
135173962 |
1 |
SO5C13H22 |
AB5C13D22 |
-249.15 |
5.28 |
-10.69 |
-0.07 |
0 |
|
|
433820 |
135173963 |
1 |
NO3C12H27 |
AB3C12D27 |
-165.76 |
3.34 |
-9.24 |
2.28 |
0 |
|
|
433821 |
135173964 |
1 |
S2O8C21H36 |
A2B8C21D36 |
-400.72 |
3.09 |
-10.4 |
-0.05 |
0 |
|
|
433822 |
135173965 |
1 |
IN3O3C13H26 |
AB3C3D13E26 |
-123.03 |
4.77 |
-8.36 |
-2.17 |
0 |
|
|
433823 |
135173966 |
1 |
SF3O3N7C27H30 |
AB3C3D7E27F30 |
-156.99 |
6.71 |
-8.38 |
-1.1 |
0 |
|
|
433824 |
135173967 |
2 |
NOC7H15 |
ABC7D15 |
-104.75 |
1.24 |
-8.78 |
1.14 |
0 |
|
|
433825 |
135173968 |
1 |
NOC13H29 |
ABC13D29 |
-93.72 |
2.84 |
-8.93 |
2.22 |
0 |
|
|
433826 |
135173969 |
1 |
NC14H29 |
AB14C29 |
-58.02 |
1.52 |
-8.42 |
3.02 |
0 |
|
|
433827 |
135173970 |
1 |
SN2O2C20H26 |
AB2C2D20E26 |
-30.44 |
6.43 |
-9.31 |
-0.67 |
0 |
|
|
433828 |
135173971 |
1 |
O3C17H18 |
A3B17C18 |
-70.67 |
3.95 |
-9.03 |
-0.26 |
0 |
|
|
433829 |
135173972 |
1 |
NOC19H39 |
ABC19D39 |
-104.71 |
1.1 |
-8.77 |
2.12 |
0 |
|
|
433830 |
135173973 |
1 |
ON2C15H28 |
AB2C15D28 |
-70.4 |
3.73 |
-8.42 |
2.33 |
0 |
|
|
433831 |
135173974 |
1 |
ON4C12H20 |
AB4C12D20 |
9.04 |
3.28 |
-8.41 |
-0.36 |
0 |
|
|
433832 |
135173975 |
1 |
I2N3C12H21 |
A2B3C12D21 |
24.79 |
1.15 |
-8.48 |
-1.46 |
0 |
|
|
433833 |
135173976 |
1 |
ON3C20H41 |
AB3C20D41 |
-73.15 |
1.34 |
-8.42 |
2.46 |
0 |
|
|
433834 |
135173977 |
1 |
SF2O2N3H23C24 |
AB2C2D3E23F24 |
-101.14 |
3.0 |
-8.65 |
-0.42 |
0 |
|
|
433835 |
135173978 |
1 |
FSO3N6C30H31 |
ABC3D6E30F31 |
-60.77 |
6.84 |
-8.68 |
-1.07 |
0 |
|
|
433836 |
135173979 |
1 |
FO4N6C30H37 |
AB4C6D30E37 |
-154.17 |
5.42 |
-8.29 |
-0.98 |
0 |
|
|
433837 |
135173980 |
1 |
ClO4N5C23H26 |
AB4C5D23E26 |
-24.42 |
5.58 |
-8.9 |
-1.01 |
0 |
|
|
433838 |
135173981 |
1 |
F3O3N4H19C31 |
A3B3C4D19E31 |
-102.96 |
4.58 |
-9.1 |
-1.25 |
0 |
|
|
433839 |
135173982 |
1 |
NSH21C32 |
ABC21D32 |
145.24 |
2.38 |
-8.18 |
-0.47 |
0 |
|
|
433840 |
135173983 |
1 |
O3N8H24C25 |
A3B8C24D25 |
-9.79 |
6.09 |
-8.18 |
-0.68 |
0 |
|
|
433841 |
135173984 |
1 |
O2N8H24C25 |
A2B8C24D25 |
28.79 |
8.38 |
-8.37 |
-0.75 |
0 |
|
|
433842 |
135173985 |
1 |
FSO4N6C23H23 |
ABC4D6E23F23 |
-125.1 |
6.08 |
-8.82 |
-1.17 |
0 |
|
|
433843 |
135173986 |
1 |
ON2C12H26 |
AB2C12D26 |
-74.4 |
1.84 |
-8.01 |
2.28 |
0 |
|
|
433844 |
135173987 |
1 |
N3C18H31 |
A3B18C31 |
-9.62 |
1.66 |
-8.11 |
0.18 |
0 |
|
|
433845 |
135173988 |
1 |
ON2C15H22 |
AB2C15D22 |
-14.21 |
3.26 |
-8.86 |
0.34 |
0 |
|
|
433846 |
135173989 |
1 |
FSO3N6C16H19 |
ABC3D6E16F19 |
-115.47 |
7.12 |
-8.82 |
-1.12 |
0 |
|
|
433847 |
135173990 |
1 |
NOF2C10H21 |
ABC2D10E21 |
-187.66 |
3.48 |
-9.01 |
1.73 |
0 |
|
|
433848 |
135173991 |
1 |
ClFO3N8C25H28 |
ABC3D8E25F28 |
-93.45 |
5.52 |
-8.64 |
-0.95 |
0 |
|
|
433849 |
135173992 |
1 |
O3N7H21C24 |
A3B7C21D24 |
-11.03 |
10.38 |
-8.5 |
-1.02 |
0 |
|
|
433850 |
135173993 |
1 |
O3N7C26H29 |
A3B7C26D29 |
-34.11 |
2.82 |
-8.1 |
-0.48 |
0 |