List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
295750 |
117543604 |
1 |
NOH9C12 |
ABC9D12 |
60.3 |
4.21 |
-8.56 |
-0.66 |
0 |
|
|
295751 |
117543605 |
1 |
O2C13H14 |
A2B13C14 |
-12.88 |
6.16 |
-8.71 |
-0.61 |
0 |
|
|
295752 |
117543635 |
1 |
NO3C15H17 |
AB3C15D17 |
-95.02 |
3.55 |
-8.75 |
-0.12 |
0 |
|
|
295753 |
117543699 |
1 |
ClOC9H17 |
ABC9D17 |
-98.68 |
2.59 |
-10.4 |
0.78 |
0 |
|
|
295754 |
117543700 |
1 |
ClOC8H15 |
ABC8D15 |
-90.72 |
1.57 |
-10.39 |
0.74 |
0 |
|
|
295755 |
117543701 |
1 |
ClO3C11H15 |
AB3C11D15 |
-133.05 |
3.07 |
-9.0 |
-0.06 |
0 |
|
|
295756 |
117543703 |
1 |
NOC8H9 |
ABC8D9 |
15.04 |
2.98 |
-10.2 |
-0.26 |
0 |
|
|
295757 |
117543704 |
1 |
ClOC9H9 |
ABC9D9 |
-5.27 |
1.93 |
-9.61 |
-0.27 |
0 |
|
|
295758 |
117543705 |
1 |
OC12H16 |
AB12C16 |
-14.23 |
2.72 |
-9.22 |
0.27 |
0 |
|
|
295759 |
117543712 |
1 |
O3C12H16 |
A3B12C16 |
-82.18 |
2.78 |
-8.18 |
0.09 |
0 |
|
|
295760 |
117543713 |
1 |
O3C12H14 |
A3B12C14 |
-72.37 |
3.53 |
-8.75 |
0.01 |
0 |
|
|
295761 |
117543716 |
1 |
FO2C10H11 |
AB2C10D11 |
-79.76 |
1.35 |
-8.95 |
-0.16 |
0 |
|
|
295762 |
117543734 |
1 |
ON2C12H18 |
AB2C12D18 |
-30.57 |
3.44 |
-9.09 |
-0.09 |
0 |
|
|
295763 |
117543760 |
1 |
FNOC13H18 |
ABCD13E18 |
-88.8 |
1.36 |
-9.03 |
-0.02 |
0 |
|
|
295764 |
117543761 |
1 |
ON2C15H20 |
AB2C15D20 |
-22.97 |
1.8 |
-8.4 |
0.06 |
0 |
|
|
295765 |
117543762 |
1 |
NO2C16H25 |
AB2C16D25 |
-96.38 |
1.56 |
-8.54 |
0.38 |
0 |
|
|
295766 |
117543763 |
1 |
FNO2C14H20 |
ABC2D14E20 |
-124.73 |
0.7 |
-8.78 |
-0.01 |
0 |
|
|
295767 |
117543772 |
1 |
NO2C16H25 |
AB2C16D25 |
-92.67 |
3.57 |
-8.51 |
0.4 |
0 |
|
|
295768 |
117543819 |
1 |
NO2C15H21 |
AB2C15D21 |
-74.06 |
4.37 |
-8.59 |
0.26 |
0 |
|
|
295769 |
117543840 |
2 |
NC7H11 |
AB7C11 |
-0.07 |
2.21 |
-8.63 |
0.48 |
0 |
|
|
295770 |
117543858 |
2 |
NOC7H10 |
ABC7D10 |
-56.16 |
2.23 |
-8.62 |
0.02 |
0 |
|
|
295771 |
117543888 |
1 |
ON2C12H18 |
AB2C12D18 |
-32.82 |
2.6 |
-8.89 |
-0.03 |
0 |
|
|
295772 |
117543895 |
1 |
FNOC13H18 |
ABCD13E18 |
-88.62 |
2.49 |
-8.87 |
0.04 |
0 |
|
|
295773 |
117543904 |
1 |
NOC16H25 |
ABC16D25 |
-60.61 |
2.57 |
-8.78 |
0.46 |
0 |
|
|
295774 |
117543906 |
1 |
NO2C15H23 |
AB2C15D23 |
-89.7 |
3.89 |
-8.7 |
0.34 |
0 |
|
|
295775 |
117543919 |
1 |
NO2C16H25 |
AB2C16D25 |
-97.99 |
2.03 |
-8.52 |
0.4 |
0 |
|
|
295776 |
117543926 |
1 |
NOC15H23 |
ABC15D23 |
-59.32 |
2.65 |
-8.72 |
0.45 |
0 |
|
|
295777 |
117543963 |
1 |
NO3C14H17 |
AB3C14D17 |
-91.82 |
3.54 |
-8.72 |
-0.08 |
0 |
|
|
295778 |
117543965 |
1 |
NO3C15H21 |
AB3C15D21 |
-110.06 |
4.92 |
-8.58 |
0.32 |
0 |
|
|
295779 |
117543972 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-111.96 |
3.62 |
-8.83 |
-0.06 |
0 |
|
|
295780 |
117543975 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-111.32 |
2.82 |
-8.89 |
-0.26 |
0 |
|
|
295781 |
117544004 |
1 |
ON2C14H22 |
AB2C14D22 |
-32.91 |
2.84 |
-8.57 |
0.34 |
0 |
|
|
295782 |
117544006 |
1 |
ClN2C13H19 |
AB2C13D19 |
-3.31 |
1.64 |
-8.82 |
0.0 |
0 |
|
|
295783 |
117544009 |
1 |
N3C15H25 |
A3B15C25 |
8.11 |
1.8 |
-8.04 |
0.55 |
0 |
|
|
295784 |
117544021 |
1 |
FN2C13H19 |
AB2C13D19 |
-41.36 |
1.5 |
-8.8 |
0.02 |
0 |
|
|
295785 |
117544028 |
1 |
ON2C15H24 |
AB2C15D24 |
-41.67 |
1.52 |
-8.39 |
0.49 |
0 |
|
|
295786 |
117544035 |
2 |
NC4H9 |
AB4C9 |
-24.24 |
2.43 |
-8.52 |
2.76 |
0 |
|
|
295787 |
117544038 |
2 |
NC5H11 |
AB5C11 |
-33.84 |
2.22 |
-8.52 |
2.78 |
0 |
|
|
295788 |
117544039 |
1 |
N2C11H24 |
A2B11C24 |
-39.66 |
2.25 |
-8.51 |
2.79 |
0 |
|
|
295789 |
117544040 |
1 |
N2C13H26 |
A2B13C26 |
-40.36 |
1.97 |
-8.47 |
2.72 |
0 |
|
|
295790 |
117544056 |
1 |
NO2C15H23 |
AB2C15D23 |
-85.0 |
1.69 |
-8.69 |
0.34 |
0 |
|
|
295791 |
117544057 |
1 |
NO2C15H23 |
AB2C15D23 |
-84.14 |
2.18 |
-8.62 |
0.32 |
0 |
|
|
295792 |
117544069 |
1 |
FNOC14H20 |
ABCD14E20 |
-92.52 |
2.12 |
-8.82 |
0.02 |
0 |
|
|
295793 |
117544070 |
1 |
ON2C16H22 |
AB2C16D22 |
-26.51 |
2.6 |
-8.38 |
0.06 |
0 |
|
|
295794 |
117544089 |
1 |
ON2C13H18 |
AB2C13D18 |
-18.59 |
2.12 |
-8.97 |
-0.16 |
0 |
|
|
295795 |
117544122 |
1 |
NOC11H21 |
ABC11D21 |
-68.85 |
2.74 |
-8.59 |
0.64 |
0 |
|
|
295796 |
117544197 |
1 |
NOC16H25 |
ABC16D25 |
-64.05 |
1.54 |
-8.74 |
0.64 |
0 |
|
|
295797 |
117544202 |
1 |
NOC11H23 |
ABC11D23 |
-88.54 |
2.02 |
-8.63 |
2.65 |
0 |
|
|
295798 |
117544258 |
1 |
NO2C15H23 |
AB2C15D23 |
-82.85 |
3.23 |
-8.77 |
0.27 |
0 |
|
|
295799 |
117544294 |
1 |
NOC15H21 |
ABC15D21 |
-39.53 |
3.4 |
-8.78 |
0.46 |
0 |
|
|
295800 |
117544308 |
1 |
NO2C16H23 |
AB2C16D23 |
-78.0 |
4.03 |
-8.63 |
0.37 |
0 |
|
|
295801 |
117544310 |
1 |
NO3C15H19 |
AB3C15D19 |
-94.69 |
3.63 |
-8.67 |
0.05 |
0 |
|
|
295802 |
117544314 |
1 |
FNOC14H18 |
ABCD14E18 |
-78.83 |
3.92 |
-8.93 |
0.01 |
0 |
|
|
295803 |
117544340 |
1 |
FN2C14H21 |
AB2C14D21 |
-44.54 |
2.59 |
-8.57 |
-0.07 |
0 |
|
|
295804 |
117544341 |
2 |
NC8H13 |
AB8C13 |
-10.37 |
2.55 |
-8.54 |
0.66 |
0 |
|
|
295805 |
117544385 |
1 |
FNO4C12H12 |
ABC4D12E12 |
-188.58 |
5.72 |
-9.45 |
-0.69 |
0 |
|
|
295806 |
117544493 |
1 |
ClN2C14H21 |
AB2C14D21 |
-3.9 |
1.67 |
-8.91 |
-0.04 |
0 |
|
|
295807 |
117544546 |
1 |
NO2C16H25 |
AB2C16D25 |
-92.09 |
2.34 |
-8.49 |
0.37 |
0 |
|
|
295808 |
117544637 |
2 |
NC6H13 |
AB6C13 |
-43.15 |
0.43 |
-8.38 |
2.74 |
0 |
|
|
295809 |
117544681 |
1 |
SCl2N2H8C10 |
AB2C2D8E10 |
34.09 |
1.98 |
-8.64 |
-0.91 |
0 |
|
|
295810 |
117544709 |
1 |
SN2O2C12H12 |
AB2C2D12E12 |
-12.78 |
2.11 |
-8.2 |
-0.82 |
0 |
|
|
295811 |
117544742 |
1 |
BrSN2H9C10 |
ABC2D9E10 |
53.41 |
2.86 |
-8.55 |
-0.98 |
0 |
|
|
295812 |
117544743 |
1 |
SN2O2C13H16 |
AB2C2D13E16 |
-38.71 |
3.24 |
-8.0 |
-0.53 |
0 |
|
|
295813 |
117544777 |
1 |
O4C13H16 |
A4B13C16 |
-140.93 |
7.3 |
-8.84 |
-0.25 |
0 |
|
|
295814 |
117544785 |
2 |
O2C7H8 |
A2B7C8 |
-135.76 |
6.93 |
-8.85 |
-0.38 |
0 |
|
|
295815 |
117544865 |
1 |
SO2C12H16 |
AB2C12D16 |
-68.07 |
2.35 |
-8.66 |
0.1 |
0 |
|
|
295816 |
117544869 |
1 |
SO2C13H18 |
AB2C13D18 |
-71.53 |
2.55 |
-8.69 |
0.14 |
0 |
|
|
295817 |
117544912 |
1 |
NSC12H15 |
ABC12D15 |
15.25 |
3.28 |
-8.45 |
-0.01 |
0 |
|
|
295818 |
117544913 |
1 |
OSC13H20 |
ABC13D20 |
-58.12 |
3.81 |
-8.61 |
0.24 |
0 |
|
|
295819 |
117544956 |
1 |
SN2C13H16 |
AB2C13D16 |
35.27 |
3.17 |
-8.89 |
-0.58 |
0 |
|
|
295820 |
117544961 |
1 |
ClSN2C12H13 |
ABC2D12E13 |
35.06 |
1.33 |
-9.22 |
-0.93 |
0 |
|
|
295821 |
117544962 |
1 |
SN2C15H20 |
AB2C15D20 |
26.08 |
3.09 |
-8.88 |
-0.61 |
0 |
|
|
295822 |
117544963 |
1 |
SN3C14H19 |
AB3C14D19 |
44.87 |
4.83 |
-8.14 |
-0.44 |
0 |
|
|
295823 |
117544965 |
1 |
OSN2C14H18 |
ABC2D14E18 |
-2.51 |
3.81 |
-8.62 |
-0.55 |
0 |
|
|
295824 |
117544967 |
1 |
BrSN2C12H13 |
ABC2D12E13 |
47.07 |
1.33 |
-9.23 |
-0.94 |
0 |