List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
439012 |
135228774 |
1 |
O2N3C29H35 |
A2B3C29D35 |
1.95 |
11.51 |
-7.57 |
-0.46 |
0 |
|
|
439013 |
135228775 |
1 |
NO3C30H43 |
AB3C30D43 |
-126.07 |
10.0 |
-8.52 |
-0.82 |
0 |
|
|
439014 |
135228776 |
1 |
N3O5C32H43 |
A3B5C32D43 |
-133.42 |
9.43 |
-8.75 |
-0.82 |
0 |
|
|
439015 |
135228777 |
1 |
BrNO2C13H18 |
ABC2D13E18 |
-75.26 |
2.52 |
-8.82 |
-0.15 |
0 |
|
|
439016 |
135228778 |
1 |
NO3C21H27 |
AB3C21D27 |
-122.28 |
5.93 |
-8.91 |
-0.54 |
0 |
|
|
439017 |
135228779 |
1 |
ClON2C19H25 |
ABC2D19E25 |
-40.91 |
3.46 |
-8.98 |
-0.3 |
0 |
|
|
439018 |
135228780 |
1 |
NC24H37 |
AB24C37 |
26.2 |
1.9 |
-8.64 |
0.4 |
0 |
|
|
439019 |
135228781 |
1 |
ON4C29H36 |
AB4C29D36 |
40.46 |
3.05 |
-7.68 |
-0.6 |
0 |
|
|
439020 |
135228783 |
1 |
NO2C24H35 |
AB2C24D35 |
-63.0 |
1.84 |
-8.2 |
0.36 |
0 |
|
|
439021 |
135228784 |
1 |
NC15H21 |
AB15C21 |
21.26 |
1.76 |
-8.81 |
0.38 |
0 |
|
|
439022 |
135228785 |
1 |
ON3C30H35 |
AB3C30D35 |
39.53 |
4.68 |
-7.45 |
-0.6 |
0 |
|
|
439023 |
135228786 |
1 |
O14C31H44 |
A14B31C44 |
-595.33 |
1.86 |
-8.54 |
-0.22 |
0 |
|
|
439024 |
135228787 |
1 |
FN4C29H35 |
AB4C29D35 |
34.83 |
6.17 |
-7.62 |
-0.35 |
0 |
|
|
439025 |
135228788 |
1 |
NO3C20H27 |
AB3C20D27 |
-106.47 |
3.07 |
-9.15 |
0.02 |
0 |
|
|
439026 |
135228789 |
1 |
N3O4C26H31 |
A3B4C26D31 |
-112.03 |
5.07 |
-9.04 |
-1.19 |
0 |
|
|
439027 |
135228790 |
1 |
NC20H27 |
AB20C27 |
66.91 |
1.86 |
-8.76 |
-0.72 |
0 |
|
|
439028 |
135228791 |
1 |
ON3C30H41 |
AB3C30D41 |
9.06 |
6.26 |
-7.8 |
-0.62 |
0 |
|
|
439029 |
135228792 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-34.51 |
9.87 |
-9.14 |
-0.91 |
0 |
|
|
439030 |
135228793 |
1 |
F2O2N4C21H24 |
A2B2C4D21E24 |
-88.18 |
4.2 |
-9.04 |
-1.22 |
0 |
|
|
439031 |
135228794 |
1 |
ON4C24H32 |
AB4C24D32 |
-16.9 |
5.14 |
-8.9 |
-0.52 |
0 |
|
|
439032 |
135228795 |
1 |
N2O5C30H38 |
A2B5C30D38 |
-187.68 |
10.36 |
-8.53 |
-0.84 |
0 |
|
|
439033 |
135228796 |
1 |
N3O3C27H37 |
A3B3C27D37 |
-91.29 |
10.79 |
-8.54 |
-0.95 |
0 |
|
|
439034 |
135228797 |
1 |
N3O4C25H29 |
A3B4C25D29 |
-117.54 |
8.18 |
-9.3 |
-1.5 |
0 |
|
|
439035 |
135228798 |
1 |
ON2C35H48 |
AB2C35D48 |
-22.79 |
8.31 |
-8.45 |
-0.61 |
0 |
|
|
439036 |
135228799 |
2 |
NOC12H18 |
ABC12D18 |
-96.15 |
2.25 |
-9.04 |
0.07 |
0 |
|
|
439037 |
135228800 |
1 |
ON4C27H34 |
AB4C27D34 |
5.29 |
5.04 |
-8.57 |
-0.54 |
0 |
|
|
439038 |
135228801 |
1 |
SC31H40 |
AB31C40 |
92.3 |
0.91 |
-8.25 |
0.24 |
0 |
|
|
439039 |
135228802 |
1 |
O2N5C32H43 |
A2B5C32D43 |
-38.61 |
14.41 |
-8.46 |
-0.97 |
0 |
|
|
439040 |
135228803 |
1 |
ON4C33H42 |
AB4C33D42 |
36.51 |
8.77 |
-7.64 |
-0.52 |
0 |
|
|
439041 |
135228804 |
1 |
N3O4C26H31 |
A3B4C26D31 |
-114.13 |
12.53 |
-8.37 |
-1.17 |
0 |
|
|
439042 |
135228805 |
1 |
N3O5C25H29 |
A3B5C25D29 |
-136.97 |
9.67 |
-8.55 |
-1.26 |
0 |
|
|
439043 |
135228806 |
1 |
N2O2C25H30 |
A2B2C25D30 |
-21.15 |
6.7 |
-8.66 |
-0.92 |
0 |
|
|
439044 |
135228807 |
2 |
NC5H11 |
AB5C11 |
-18.87 |
2.26 |
-8.48 |
1.4 |
0 |
|
|
439045 |
135228808 |
1 |
N3C32H39 |
A3B32C39 |
98.22 |
9.05 |
-7.57 |
-0.26 |
0 |
|
|
439046 |
135228809 |
1 |
OSN3C8H11 |
ABC3D8E11 |
7.41 |
4.05 |
-8.76 |
-0.89 |
0 |
|
|
439047 |
135228810 |
1 |
NOC16H25 |
ABC16D25 |
-39.17 |
2.65 |
-8.19 |
0.54 |
0 |
|
|
439048 |
135228811 |
1 |
NC14H19 |
AB14C19 |
34.16 |
1.56 |
-8.93 |
-0.19 |
0 |
|
|
439049 |
135228812 |
1 |
NOC16H25 |
ABC16D25 |
-39.42 |
2.31 |
-8.34 |
0.3 |
0 |
|
|
439050 |
135228813 |
1 |
N3O3C34H53 |
A3B3C34D53 |
-134.14 |
10.04 |
-8.58 |
-0.83 |
0 |
|
|
439051 |
135228814 |
1 |
ClIOC15H18 |
ABCD15E18 |
-38.42 |
3.47 |
-9.6 |
-1.09 |
0 |
|
|
439052 |
135228815 |
1 |
N2O5C20H22 |
A2B5C20D22 |
-187.46 |
11.36 |
-9.63 |
-1.57 |
0 |
|
|
439053 |
135228816 |
1 |
N3O4C26H29 |
A3B4C26D29 |
-116.83 |
6.74 |
-9.16 |
-1.04 |
0 |
|
|
439054 |
135228817 |
1 |
ON2C24H30 |
AB2C24D30 |
-14.4 |
6.78 |
-7.53 |
-0.7 |
0 |
|
|
439055 |
135228818 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-38.58 |
9.32 |
-8.24 |
-0.95 |
0 |
|
|
439056 |
135228819 |
1 |
N4O5C28H32 |
A4B5C28D32 |
-132.43 |
6.79 |
-8.67 |
-1.14 |
0 |
|
|
439057 |
135228820 |
1 |
FON2C19H21 |
ABC2D19E21 |
-42.86 |
5.68 |
-9.1 |
-0.89 |
0 |
|
|
439058 |
135228821 |
1 |
N3C30H41 |
A3B30C41 |
38.21 |
6.21 |
-7.27 |
-0.1 |
0 |
|
|
439059 |
135228822 |
1 |
BrFO2C8H8 |
ABC2D8E8 |
-110.5 |
2.32 |
-9.87 |
-0.7 |
0 |
|
|
439060 |
135228823 |
1 |
NOC20H29 |
ABC20D29 |
-37.27 |
2.98 |
-8.98 |
0.02 |
0 |
|
|
439061 |
135228824 |
1 |
N4O4C29H34 |
A4B4C29D34 |
-111.38 |
14.78 |
-8.56 |
-1.37 |
0 |
|
|
439062 |
135228825 |
1 |
N4O5C24H30 |
A4B5C24D30 |
-158.78 |
12.14 |
-9.43 |
-1.42 |
0 |
|
|
439063 |
135228826 |
1 |
N2O3C27H32 |
A2B3C27D32 |
-75.15 |
4.31 |
-8.64 |
-0.85 |
0 |
|
|
439064 |
135228827 |
1 |
ON2C24H30 |
AB2C24D30 |
14.54 |
2.24 |
-7.54 |
-0.66 |
0 |
|
|
439065 |
135228828 |
1 |
N3O3C26H29 |
A3B3C26D29 |
-73.4 |
6.22 |
-9.25 |
-1.11 |
0 |
|
|
439066 |
135228829 |
1 |
ON4C29H36 |
AB4C29D36 |
43.15 |
7.34 |
-7.74 |
-0.56 |
0 |
|
|
439067 |
135228830 |
1 |
PN2O2C18H27 |
AB2C2D18E27 |
-56.72 |
1.67 |
-9.02 |
-0.25 |
0 |
|
|
439068 |
135228831 |
1 |
ClNC22H32 |
ABC22D32 |
-14.22 |
3.12 |
-9.01 |
-0.02 |
0 |
|
|
439069 |
135228832 |
2 |
NC12H18 |
AB12C18 |
3.9 |
0.38 |
-8.24 |
0.08 |
0 |
|
|
439070 |
135228833 |
1 |
N2O3C22H26 |
A2B3C22D26 |
-87.97 |
7.25 |
-9.18 |
-1.1 |
0 |
|
|
439071 |
135228834 |
1 |
NC16H21 |
AB16C21 |
44.19 |
0.42 |
-9.04 |
0.24 |
0 |
|
|
439072 |
135228835 |
1 |
NO4C25H25 |
AB4C25D25 |
-120.84 |
14.05 |
-9.28 |
-1.27 |
0 |
|
|
439073 |
135228836 |
1 |
N2O6C27H30 |
A2B6C27D30 |
-195.47 |
13.12 |
-9.34 |
-1.44 |
0 |
|
|
439074 |
135228837 |
1 |
N2O3C30H36 |
A2B3C30D36 |
-47.01 |
6.74 |
-7.45 |
-0.76 |
0 |
|
|
439075 |
135228838 |
1 |
NC23H37 |
AB23C37 |
-11.85 |
1.05 |
-8.67 |
0.36 |
0 |
|
|
439076 |
135228839 |
1 |
NO3C26H27 |
AB3C26D27 |
-64.77 |
9.82 |
-8.57 |
-1.17 |
0 |
|
|
439077 |
135228840 |
1 |
FNC22H32 |
ABC22D32 |
-50.18 |
1.92 |
-9.14 |
0.0 |
0 |
|
|
439078 |
135228841 |
1 |
NO4C27H29 |
AB4C27D29 |
-135.54 |
12.15 |
-8.97 |
-1.32 |
0 |
|
|
439079 |
135228842 |
2 |
NOC15H19 |
ABC15D19 |
-55.06 |
11.03 |
-8.33 |
-0.73 |
0 |
|
|
439080 |
135228843 |
1 |
NC31H37 |
AB31C37 |
38.07 |
5.3 |
-7.35 |
-0.29 |
0 |
|
|
439081 |
135228844 |
1 |
NC22H35 |
AB22C35 |
-8.83 |
1.1 |
-8.67 |
0.37 |
0 |
|
|
439082 |
135228845 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-104.01 |
12.17 |
-8.85 |
-1.4 |
0 |
|
|
439083 |
135228846 |
2 |
NOC13H14 |
ABC13D14 |
-46.9 |
7.45 |
-9.21 |
-0.99 |
0 |
|
|
439084 |
135228847 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-58.52 |
8.2 |
-8.71 |
-1.15 |
0 |
|
|
439085 |
135228848 |
2 |
NOC16H21 |
ABC16D21 |
-19.98 |
8.96 |
-7.73 |
-0.46 |
0 |
|
|
439086 |
135228849 |
1 |
N3C28H37 |
A3B28C37 |
51.2 |
4.6 |
-7.37 |
-0.2 |
0 |