List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
361589 |
127303855 |
2 |
ON3C10H12 |
AB3C10D12 |
53.5 |
5.07 |
-9.84 |
-1.3 |
0 |
|
|
361590 |
127303856 |
1 |
ON5C20H33 |
AB5C20D33 |
-8.76 |
4.9 |
-8.78 |
0.18 |
0 |
|
|
361591 |
127303857 |
1 |
OS2N6C14H18 |
AB2C6D14E18 |
77.57 |
6.75 |
-9.26 |
-1.3 |
0 |
|
|
361592 |
127303858 |
1 |
O2N5C22H33 |
A2B5C22D33 |
-55.5 |
5.07 |
-9.34 |
0.07 |
0 |
|
|
361593 |
127303859 |
1 |
O2N7C19H27 |
A2B7C19D27 |
13.65 |
3.64 |
-9.57 |
0.03 |
0 |
|
|
361594 |
127303860 |
1 |
OSN8C15H22 |
ABC8D15E22 |
93.44 |
8.91 |
-9.43 |
-0.71 |
0 |
|
|
361595 |
127303861 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-62.59 |
7.57 |
-9.4 |
0.29 |
0 |
|
|
361596 |
127303862 |
1 |
ON7C19H21 |
AB7C19D21 |
101.03 |
4.88 |
-9.84 |
-1.36 |
0 |
|
|
361597 |
127303863 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-59.92 |
7.88 |
-9.45 |
0.19 |
0 |
|
|
361598 |
127303864 |
1 |
ON6C20H22 |
AB6C20D22 |
93.86 |
3.96 |
-9.46 |
-0.85 |
0 |
|
|
361599 |
127303865 |
2 |
ON3C10H13 |
AB3C10D13 |
-17.56 |
6.2 |
-9.2 |
-0.19 |
0 |
|
|
361600 |
127303866 |
1 |
FO2N5C21H24 |
AB2C5D21E24 |
-51.01 |
5.65 |
-9.07 |
-0.42 |
0 |
|
|
361601 |
127303867 |
1 |
SO2N5C18H27 |
AB2C5D18E27 |
-35.24 |
7.46 |
-9.0 |
-0.05 |
0 |
|
|
361602 |
127303868 |
1 |
OSN7C18H19 |
ABC7D18E19 |
106.05 |
7.06 |
-9.65 |
-1.79 |
0 |
|
|
361603 |
127303869 |
1 |
ON7C21H27 |
AB7C21D27 |
72.68 |
6.61 |
-9.42 |
-0.84 |
0 |
|
|
361604 |
127303870 |
1 |
SO2N5C19H29 |
AB2C5D19E29 |
-45.52 |
2.87 |
-9.28 |
-0.35 |
0 |
|
|
361605 |
127303871 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-79.97 |
7.51 |
-9.5 |
0.29 |
0 |
|
|
361606 |
127303872 |
1 |
N3O3C16H27 |
A3B3C16D27 |
-139.36 |
4.71 |
-9.05 |
0.67 |
0 |
|
|
361607 |
127303873 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-143.14 |
3.51 |
-8.46 |
0.94 |
0 |
|
|
361608 |
127303874 |
2 |
ON2C11H12 |
AB2C11D12 |
7.74 |
8.44 |
-9.02 |
-1.02 |
0 |
|
|
361609 |
127303875 |
2 |
ON2C8H13 |
AB2C8D13 |
-71.89 |
4.0 |
-9.39 |
0.52 |
0 |
|
|
361610 |
127303876 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-73.73 |
6.81 |
-8.9 |
-0.45 |
0 |
|
|
361611 |
127303877 |
1 |
ON4C23H26 |
AB4C23D26 |
24.73 |
8.98 |
-9.06 |
-0.84 |
0 |
|
|
361612 |
127303878 |
1 |
SO2N4C18H30 |
AB2C4D18E30 |
-76.89 |
9.51 |
-8.34 |
0.21 |
0 |
|
|
361613 |
127303879 |
1 |
ON5C13H23 |
AB5C13D23 |
-13.69 |
10.51 |
-8.65 |
0.18 |
0 |
|
|
361614 |
127303880 |
1 |
SO3N5C15H25 |
AB3C5D15E25 |
-103.42 |
5.61 |
-9.49 |
0.22 |
0 |
|
|
361615 |
127303881 |
1 |
OSN5C20H25 |
ABC5D20E25 |
14.38 |
8.51 |
-8.95 |
-1.12 |
0 |
|
|
361616 |
127303882 |
2 |
ON2C10H15 |
AB2C10D15 |
-78.3 |
7.1 |
-9.43 |
0.36 |
0 |
|
|
361617 |
127303883 |
1 |
SO2N5C19H29 |
AB2C5D19E29 |
-49.56 |
6.77 |
-9.26 |
-0.22 |
0 |
|
|
361618 |
127303884 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-30.62 |
2.81 |
-8.96 |
-0.44 |
0 |
|
|
361619 |
127303885 |
1 |
ON4C24H28 |
AB4C24D28 |
36.1 |
4.7 |
-8.81 |
-0.43 |
0 |
|
|
361620 |
127303886 |
1 |
SO2N5C19H31 |
AB2C5D19E31 |
-69.21 |
8.92 |
-8.73 |
0.13 |
0 |
|
|
361621 |
127303904 |
2 |
ON3C10H14 |
AB3C10D14 |
-49.74 |
7.15 |
-9.16 |
-0.16 |
0 |
|
|
361622 |
127303905 |
1 |
SO2N5C18H29 |
AB2C5D18E29 |
-70.32 |
8.86 |
-9.27 |
-0.33 |
0 |
|
|
361623 |
127303906 |
1 |
SO3N5C16H27 |
AB3C5D16E27 |
-104.57 |
8.06 |
-9.52 |
0.06 |
0 |
|
|
361624 |
127303907 |
1 |
SO2N5C19H31 |
AB2C5D19E31 |
-80.09 |
5.33 |
-8.72 |
0.32 |
0 |
|
|
361625 |
127303915 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-24.63 |
3.35 |
-8.86 |
-0.33 |
0 |
|
|
361626 |
127303916 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-90.15 |
4.28 |
-8.94 |
-0.29 |
0 |
|
|
361627 |
127303917 |
1 |
O3N5C16H21 |
A3B5C16D21 |
-44.1 |
3.17 |
-8.98 |
-0.65 |
0 |
|
|
361628 |
127303918 |
1 |
O3N5C18H29 |
A3B5C18D29 |
-93.48 |
2.7 |
-8.83 |
-0.23 |
0 |
|
|
361629 |
127303919 |
1 |
O3N6C15H22 |
A3B6C15D22 |
-15.15 |
4.46 |
-9.08 |
-0.36 |
0 |
|
|
361630 |
127303920 |
2 |
ON2C11H12 |
AB2C11D12 |
15.82 |
3.64 |
-8.77 |
-0.58 |
0 |
|
|
361631 |
127303921 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-33.25 |
5.89 |
-8.74 |
-0.3 |
0 |
|
|
361632 |
127303926 |
1 |
SO2N6C12H16 |
AB2C6D12E16 |
42.87 |
4.49 |
-8.97 |
-1.38 |
0 |
|
|
361633 |
127303927 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-1.07 |
0.77 |
-8.29 |
-0.38 |
0 |
|
|
361634 |
127303928 |
1 |
O4N5C19H23 |
A4B5C19D23 |
-93.5 |
7.05 |
-8.85 |
-1.03 |
0 |
|
|
361635 |
127303929 |
1 |
O2N6C21H30 |
A2B6C21D30 |
-7.7 |
4.07 |
-8.7 |
-0.26 |
0 |
|
|
361636 |
127303930 |
1 |
O2N7C12H17 |
A2B7C12D17 |
42.66 |
2.59 |
-9.0 |
-0.42 |
0 |
|
|
361637 |
127303931 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-48.92 |
3.33 |
-8.84 |
-0.32 |
0 |
|
|
361638 |
127303932 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-75.96 |
4.19 |
-9.05 |
-0.34 |
0 |