List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
339779 |
127261788 |
1 |
NO2C17H17 |
AB2C17D17 |
5.14 |
5.31 |
-8.63 |
-0.23 |
0 |
|
|
339780 |
127261789 |
1 |
NO2C17H17 |
AB2C17D17 |
3.86 |
5.26 |
-8.54 |
-0.21 |
0 |
|
|
339781 |
127261790 |
1 |
N2O3H14C16 |
A2B3C14D16 |
41.62 |
6.49 |
-9.69 |
-1.66 |
0 |
|
|
339782 |
127261791 |
1 |
NOSH15C16 |
ABCD15E16 |
50.78 |
2.92 |
-8.89 |
-0.37 |
0 |
|
|
339783 |
127261792 |
1 |
NOSH15C16 |
ABCD15E16 |
49.18 |
2.88 |
-8.85 |
-0.42 |
0 |
|
|
339784 |
127261793 |
1 |
NOSC11H13 |
ABCD11E13 |
22.8 |
2.59 |
-8.85 |
-0.36 |
0 |
|
|
339785 |
127261794 |
1 |
NOSC11H13 |
ABCD11E13 |
21.69 |
2.3 |
-8.89 |
-0.46 |
0 |
|
|
339786 |
127261795 |
1 |
NOH15C16 |
ABC15D16 |
45.17 |
3.54 |
-8.99 |
-0.33 |
0 |
|
|
339787 |
127261796 |
1 |
N2O3H14C16 |
A2B3C14D16 |
39.85 |
6.81 |
-9.66 |
-1.59 |
0 |
|
|
339788 |
127261797 |
1 |
NOSH15C16 |
ABCD15E16 |
49.48 |
1.67 |
-9.04 |
-0.52 |
0 |
|
|
339789 |
127261798 |
1 |
NOSC11H13 |
ABCD11E13 |
22.12 |
4.5 |
-8.94 |
-0.36 |
0 |
|
|
339790 |
127261799 |
1 |
N3O5H9C10 |
A3B5C9D10 |
14.58 |
6.93 |
-10.2 |
-1.9 |
0 |
|
|
339791 |
127261800 |
1 |
ClNOC11H12 |
ABCD11E12 |
5.97 |
2.51 |
-9.26 |
-0.48 |
0 |
|
|
339792 |
127261801 |
1 |
NOC21H35 |
ABC21D35 |
-29.89 |
3.33 |
-9.52 |
0.26 |
0 |
|
|
339793 |
127261802 |
1 |
NOC21H37 |
ABC21D37 |
-53.5 |
3.1 |
-9.61 |
0.27 |
0 |
|
|
339794 |
127261803 |
1 |
ClNOC11H12 |
ABCD11E12 |
7.26 |
2.49 |
-9.19 |
-0.53 |
0 |
|
|
339795 |
127261804 |
1 |
NO3H17C19 |
AB3C17D19 |
8.52 |
2.96 |
-8.49 |
-0.81 |
0 |
|
|
339796 |
127261805 |
1 |
NOC14H23 |
ABC14D23 |
6.77 |
3.26 |
-9.06 |
0.89 |
0 |
|
|
339797 |
127261806 |
1 |
NO2C18H19 |
AB2C18D19 |
13.94 |
3.69 |
-8.99 |
0.19 |
0 |
|
|
339798 |
127261807 |
1 |
NO2C13H17 |
AB2C13D17 |
-10.95 |
3.69 |
-8.63 |
0.24 |
0 |
|
|
339799 |
127261808 |
1 |
N2O3C9H12 |
A2B3C9D12 |
-45.8 |
1.61 |
-9.93 |
0.01 |
0 |
|
|
339800 |
127261809 |
2 |
NOC4H6 |
ABC4D6 |
-0.9 |
5.59 |
-9.06 |
0.15 |
0 |
|
|
339801 |
127261810 |
1 |
N2O2C13H14 |
A2B2C13D14 |
24.08 |
5.12 |
-9.35 |
-0.02 |
0 |
|
|
339802 |
127261811 |
2 |
ON2C8H12 |
AB2C8D12 |
-80.64 |
5.36 |
-9.45 |
-0.26 |
0 |
|
|
339803 |
127261812 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-159.21 |
3.93 |
-9.32 |
0.33 |
0 |
|
|
339804 |
127261813 |
1 |
N3O3C11H19 |
A3B3C11D19 |
-146.96 |
4.05 |
-9.48 |
0.21 |
0 |
|
|
339805 |
127261814 |
1 |
ClN3O4C18H26 |
AB3C4D18E26 |
-186.2 |
4.83 |
-9.8 |
-0.6 |
0 |
|
|
339806 |
127261815 |
1 |
N3O3C8H17 |
A3B3C8D17 |
-149.89 |
2.44 |
-9.85 |
0.22 |
0 |
|
|
339807 |
127261816 |
1 |
O2N3C7H15 |
A2B3C7D15 |
-102.94 |
2.35 |
-9.73 |
0.4 |
0 |
|
|
339808 |
127261817 |
1 |
PN4O6C10H21 |
AB4C6D10E21 |
-335.3 |
6.81 |
-9.77 |
0.1 |
0 |
|
|
339809 |
127261818 |
1 |
N3O4C15H17 |
A3B4C15D17 |
-137.17 |
6.48 |
-9.46 |
-1.22 |
0 |
|
|
339810 |
127261819 |
1 |
O3N4C13H26 |
A3B4C13D26 |
-171.55 |
5.37 |
-9.41 |
0.52 |
0 |
|
|
339811 |
127261820 |
1 |
N5O5C15H21 |
A5B5C15D21 |
-130.66 |
8.82 |
-9.93 |
-1.41 |
0 |
|
|
339812 |
127261821 |
1 |
O3N4C13H26 |
A3B4C13D26 |
-170.93 |
6.03 |
-9.38 |
0.45 |
0 |
|
|
339813 |
127261822 |
1 |
O3N4C11H22 |
A3B4C11D22 |
-160.73 |
6.18 |
-9.35 |
0.52 |
0 |
|
|
339814 |
127261823 |
1 |
N4O4C9H18 |
A4B4C9D18 |
-160.58 |
4.77 |
-9.92 |
-0.41 |
0 |
|
|
339815 |
127261824 |
1 |
N3O5C9H17 |
A3B5C9D17 |
-196.83 |
2.9 |
-10.13 |
-0.79 |
0 |
|
|
339816 |
127261825 |
1 |
PN3O5C8H18 |
AB3C5D8E18 |
-287.97 |
7.02 |
-9.93 |
-0.15 |
0 |
|
|
339817 |
127261826 |
1 |
N3O3C8H17 |
A3B3C8D17 |
-151.93 |
4.88 |
-9.65 |
0.4 |
0 |
|
|
339818 |
127261827 |
1 |
N3O4C13H17 |
A3B4C13D17 |
-156.71 |
7.37 |
-9.83 |
-1.01 |
0 |
|
|
339819 |
127261828 |
4 |
NOC3H4 |
ABC3D4 |
-74.62 |
6.68 |
-9.77 |
-1.48 |
0 |
|
|
339820 |
127261829 |
1 |
N3O3C6H13 |
A3B3C6D13 |
-107.22 |
5.43 |
-9.86 |
-0.26 |
0 |
|
|
339821 |
127261830 |
1 |
O2N3C7H15 |
A2B3C7D15 |
-101.56 |
2.81 |
-9.5 |
0.68 |
0 |
|
|
339822 |
127261831 |
1 |
N4O5C12H24 |
A4B5C12D24 |
-202.74 |
7.42 |
-9.65 |
-0.76 |
0 |
|
|
339823 |
127261832 |
1 |
O4N5C15H23 |
A4B5C15D23 |
-83.26 |
11.33 |
-9.71 |
-1.26 |
0 |
|
|
339824 |
127261833 |
2 |
N2O2C9H10 |
A2B2C9D10 |
-50.66 |
10.9 |
-9.78 |
-1.29 |
0 |
|
|
339825 |
127261834 |
1 |
ClO3N4C19H29 |
AB3C4D19E29 |
-136.2 |
3.4 |
-9.6 |
-0.36 |
0 |
|
|
339826 |
127261835 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-71.03 |
5.92 |
-8.73 |
-0.27 |
0 |
|
|
339827 |
127261836 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-111.62 |
3.56 |
-9.07 |
-0.05 |
0 |
|
|
339828 |
127261837 |
1 |
N3O5C12H21 |
A3B5C12D21 |
-247.6 |
5.57 |
-9.66 |
0.07 |
0 |