List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
449789 |
135301488 |
1 |
NH17C22 |
AB17C22 |
161.5 |
3.7 |
-7.61 |
-1.19 |
0 |
|
|
449790 |
135301489 |
1 |
NO2H17C21 |
AB2C17D21 |
98.18 |
9.78 |
-6.66 |
-2.19 |
0 |
|
|
449791 |
135301498 |
1 |
NOSC6H13 |
ABCD6E13 |
-29.94 |
4.23 |
-8.48 |
0.31 |
0 |
|
|
449792 |
135301523 |
1 |
ClO2N7C26H32 |
AB2C7D26E32 |
-0.17 |
7.4 |
-8.68 |
-0.29 |
0 |
|
|
449796 |
135301563 |
1 |
NH11C13 |
AB11C13 |
156.27 |
2.33 |
-8.29 |
-0.45 |
0 |
|
|
449797 |
135301583 |
1 |
F3O3C7H9 |
A3B3C7D9 |
-302.33 |
1.81 |
-10.67 |
0.16 |
0 |
|
|
449798 |
135301601 |
1 |
ON6C26H26 |
AB6C26D26 |
104.17 |
11.72 |
-8.36 |
-1.79 |
0 |
|
|
449800 |
135301605 |
1 |
O2F4N7C26H27 |
A2B4C7D26E27 |
-157.79 |
12.39 |
-8.79 |
-0.93 |
0 |
|
|
449801 |
135301642 |
1 |
O2N3C20H31 |
A2B3C20D31 |
-112.74 |
1.81 |
-8.61 |
0.4 |
0 |
|
|
449802 |
135301654 |
1 |
OSN7C18H27 |
ABC7D18E27 |
18.34 |
3.43 |
-8.31 |
-0.34 |
0 |
|
|
449803 |
135301658 |
1 |
OSF3N5C20H24 |
ABC3D5E20F24 |
-159.51 |
4.48 |
-8.76 |
-0.43 |
0 |
|
|
449804 |
135301659 |
1 |
SF3N4C23H25 |
AB3C4D23E25 |
-103.13 |
7.1 |
-8.91 |
-0.61 |
0 |
|
|
449805 |
135301665 |
1 |
N3C13H19 |
A3B13C19 |
21.06 |
2.9 |
-8.24 |
0.12 |
0 |
|
|
449806 |
135301686 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-34.4 |
1.14 |
-8.45 |
-0.21 |
0 |
|
|
449807 |
135301696 |
1 |
ON3F4H9C10 |
AB3C4D9E10 |
-167.28 |
4.42 |
-9.42 |
-1.48 |
0 |
|
|
449808 |
135301698 |
1 |
ON3C15H21 |
AB3C15D21 |
41.76 |
4.1 |
-8.36 |
-0.31 |
0 |
|
|
449809 |
135301711 |
1 |
ON3C17H21 |
AB3C17D21 |
63.73 |
5.34 |
-8.36 |
-0.02 |
0 |
|
|
449810 |
135301732 |
2 |
FO4N5C25H32 |
AB4C5D25E32 |
-314.01 |
8.97 |
-8.23 |
-0.68 |
0 |
|
|
449811 |
135301734 |
1 |
FN8C29H29 |
AB8C29D29 |
167.42 |
9.13 |
-8.33 |
-1.81 |
0 |
|
|
449812 |
135301740 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-81.68 |
2.35 |
-8.6 |
-0.28 |
0 |
|
|
449813 |
135301764 |
1 |
FOSN5C19H24 |
ABCD5E19F24 |
-40.39 |
4.02 |
-8.73 |
-0.37 |
0 |
|
|
449814 |
135301776 |
1 |
N2C17H24 |
A2B17C24 |
28.61 |
1.02 |
-8.2 |
0.13 |
0 |
|
|
449815 |
135301780 |
1 |
NF3O3C8H12 |
AB3C3D8E12 |
-294.69 |
2.7 |
-10.23 |
-0.48 |
0 |
|
|
449816 |
135301802 |
2 |
NOC13H25 |
ABC13D25 |
-173.19 |
3.74 |
-8.94 |
0.62 |
0 |
|
|
449817 |
135301812 |
1 |
N4C13H20 |
A4B13C20 |
27.75 |
3.66 |
-8.54 |
-0.08 |
0 |
|
|
449818 |
135301826 |
2 |
FNOH5C6 |
ABCD5E6 |
-80.79 |
4.6 |
-10.43 |
-1.5 |
0 |
|
|
449819 |
135301830 |
1 |
ION3C14H18 |
ABC3D14E18 |
28.47 |
3.48 |
-8.61 |
-0.79 |
0 |
|
|
449820 |
135301843 |
2 |
ON2C9H14 |
AB2C9D14 |
-93.85 |
3.13 |
-8.82 |
-0.03 |
0 |
|
|
449821 |
135301846 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-134.32 |
3.11 |
-7.98 |
0.14 |
0 |
|
|
449822 |
135301848 |
1 |
ON3C14H21 |
AB3C14D21 |
-29.18 |
3.14 |
-8.57 |
0.5 |
0 |
|
|
449823 |
135301854 |
1 |
N5C23H27 |
A5B23C27 |
71.28 |
2.68 |
-8.56 |
-0.99 |
0 |
|
|
449824 |
135301866 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-85.61 |
3.29 |
-9.79 |
-0.55 |
0 |
|
|
449825 |
135301871 |
1 |
OF2N2C12H12 |
AB2C2D12E12 |
-76.86 |
4.72 |
-9.08 |
-1.17 |
0 |
|
|
449826 |
135301892 |
1 |
N3C20H21 |
A3B20C21 |
104.31 |
1.82 |
-8.2 |
-0.5 |
0 |
|
|
449827 |
135301896 |
2 |
F4O4N5C26H31 |
A4B4C5D26E31 |
-593.23 |
9.81 |
-8.22 |
-1.32 |
0 |
|
|
449828 |
135301946 |
1 |
N3C14H17 |
A3B14C17 |
85.6 |
2.38 |
-8.4 |
-0.24 |
0 |
|
|
449829 |
135301968 |
1 |
ClNC13H16 |
ABC13D16 |
21.43 |
2.66 |
-9.18 |
0.07 |
0 |
|
|
449830 |
135301969 |
1 |
O2N3C20H31 |
A2B3C20D31 |
-108.36 |
0.78 |
-9.13 |
0.23 |
0 |
|
|
449831 |
135301978 |
1 |
NOH9C10 |
ABC9D10 |
34.03 |
3.64 |
-10.14 |
-0.96 |
0 |
|
|
449832 |
135301991 |
1 |
O5F7N9C42H48 |
A5B7C9D42E48 |
-407.45 |
5.02 |
-8.7 |
-0.68 |
0 |
|
|
449833 |
135301998 |
1 |
O2N3C18H21 |
A2B3C18D21 |
5.79 |
5.22 |
-8.36 |
-0.16 |
0 |
|
|
449834 |
135302004 |
1 |
O4N5F7C22H28 |
A4B5C7D22E28 |
-498.32 |
4.78 |
-9.3 |
-0.92 |
0 |
|
|
449835 |
135302019 |
1 |
F2N7O7C29H43 |
A2B7C7D29E43 |
-358.56 |
5.04 |
-8.61 |
-0.47 |
1 |
|
|
449836 |
135302028 |
1 |
PO4N6C16H24 |
AB4C6D16E24 |
-110.92 |
4.13 |
0.0 |
0.0 |
0 |
|
|
449837 |
135302031 |
1 |
ClN2O7C16H25 |
AB2C7D16E25 |
-302.99 |
3.72 |
-9.79 |
-0.15 |
0 |
|
|
449838 |
135302039 |
1 |
NO5C52H105 |
AB5C52D105 |
-455.51 |
2.33 |
-8.71 |
0.84 |
0 |
|
|
449839 |
135302043 |
1 |
SN7O15C28H47 |
AB7C15D28E47 |
-663.64 |
2.64 |
-9.7 |
-0.4 |
0 |
|
|
449840 |
135302049 |
1 |
ClFO3N4H22C25 |
ABC3D4E22F25 |
-69.48 |
8.71 |
-8.99 |
-1.5 |
0 |
|
|
449841 |
135302055 |
1 |
OC21H26 |
AB21C26 |
-10.22 |
1.68 |
-8.57 |
-0.44 |
0 |
|
|
449842 |
135302059 |
1 |
OSF3N3C19H20 |
ABC3D3E19F20 |
-57.19 |
5.07 |
-7.38 |
-0.68 |
0 |