List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
338621 |
127259632 |
1 |
N3C15H17 |
A3B15C17 |
85.49 |
2.86 |
-7.72 |
-0.17 |
0 |
|
|
338622 |
127259633 |
1 |
ClO2N4H9C12 |
AB2C4D9E12 |
80.29 |
8.48 |
-9.31 |
-1.72 |
0 |
|
|
338623 |
127259634 |
1 |
OF2N7H9C15 |
AB2C7D9E15 |
46.83 |
8.4 |
-8.67 |
-2.16 |
0 |
|
|
338624 |
127259635 |
1 |
ClON2C18H19 |
ABC2D18E19 |
-6.96 |
5.09 |
-8.57 |
-0.16 |
0 |
|
|
338625 |
127259636 |
1 |
ClON2C17H17 |
ABC2D17E17 |
-3.31 |
2.47 |
-8.64 |
-0.38 |
0 |
|
|
338626 |
127259637 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-137.61 |
3.9 |
-8.76 |
-0.3 |
0 |
|
|
338627 |
127259638 |
1 |
NO3H8C17F17 |
AB3C8D17E17 |
-913.83 |
3.76 |
-10.6 |
-1.27 |
0 |
|
|
338628 |
127259639 |
1 |
NO2H10F17C19 |
AB2C10D17E19 |
-851.52 |
5.43 |
-10.26 |
-1.14 |
0 |
|
|
338629 |
127259640 |
1 |
OSN4C11H14 |
ABC4D11E14 |
25.11 |
5.69 |
-8.85 |
-1.12 |
0 |
|
|
338630 |
127259641 |
2 |
NOH10C14 |
ABC10D14 |
60.76 |
3.22 |
-8.88 |
-1.17 |
0 |
|
|
338631 |
127259642 |
1 |
N2O2H18C23 |
A2B2C18D23 |
24.11 |
3.72 |
-8.99 |
-1.07 |
0 |
|
|
338632 |
127259643 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-15.49 |
4.64 |
-9.3 |
-1.63 |
0 |
|
|
338633 |
127259644 |
1 |
O2N3C23H23 |
A2B3C23D23 |
-10.5 |
5.8 |
-9.34 |
-1.22 |
0 |
|
|
338634 |
127259645 |
1 |
O2N3C21H21 |
A2B3C21D21 |
0.86 |
3.48 |
-9.58 |
-1.24 |
0 |
|
|
338635 |
127259646 |
1 |
O2N3H21C22 |
A2B3C21D22 |
3.49 |
2.49 |
-9.52 |
-1.22 |
0 |
|
|
338636 |
127259647 |
1 |
O2N3H19C21 |
A2B3C19D21 |
10.32 |
3.31 |
-9.53 |
-1.22 |
0 |
|
|
338637 |
127259648 |
1 |
S2N4O7C15H24 |
A2B4C7D15E24 |
-225.04 |
4.45 |
-9.62 |
-1.66 |
0 |
|
|
338638 |
127259649 |
1 |
ClNO2H20C22 |
ABC2D20E22 |
-42.3 |
3.62 |
-9.13 |
-0.83 |
0 |
|
|
338639 |
127259650 |
1 |
NO3C21H25 |
AB3C21D25 |
-70.44 |
4.3 |
-8.5 |
-0.26 |
0 |
|
|
338640 |
127259651 |
1 |
N3O5H13C15 |
A3B5C13D15 |
-54.08 |
6.38 |
-9.65 |
-1.7 |
0 |
|
|
338641 |
127259652 |
1 |
N2O3H12C13 |
A2B3C12D13 |
-52.7 |
3.88 |
-10.14 |
-0.86 |
0 |
|
|
338642 |
127259653 |
1 |
NO3H10F11C15 |
AB3C10D11E15 |
-624.16 |
1.63 |
-10.12 |
-1.36 |
0 |
|
|
338643 |
127259654 |
1 |
N2O5C17H18 |
A2B5C17D18 |
-58.38 |
4.44 |
-9.62 |
-1.67 |
0 |
|
|
338645 |
127259656 |
1 |
SN3O6C11H17 |
AB3C6D11E17 |
-192.11 |
5.83 |
-8.69 |
-0.9 |
0 |
|
|
338646 |
127259657 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-30.58 |
6.87 |
-9.56 |
-0.98 |
0 |
|
|
338647 |
127259658 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-27.61 |
1.83 |
-9.43 |
-0.62 |
0 |
|
|
338648 |
127259659 |
1 |
ClNOH20C23 |
ABCD20E23 |
29.21 |
4.16 |
-9.3 |
-0.41 |
0 |
|
|
338649 |
127259660 |
1 |
O2N5C15H15 |
A2B5C15D15 |
8.12 |
8.64 |
-9.21 |
-0.83 |
0 |
|
|
338650 |
127259661 |
1 |
ON5C9H11 |
AB5C9D11 |
41.18 |
3.79 |
-9.24 |
-0.65 |
0 |
|
|
338651 |
127259662 |
1 |
OSN3H17C18 |
ABC3D17E18 |
49.57 |
8.49 |
-8.22 |
-0.78 |
0 |
|
|
338652 |
127259663 |
1 |
OSN3H15C17 |
ABC3D15E17 |
55.36 |
4.9 |
-8.26 |
-0.57 |
0 |
|
|
338653 |
127259664 |
1 |
N2O3C17H20 |
A2B3C17D20 |
-93.23 |
5.09 |
-9.27 |
-0.37 |
0 |
|
|
338654 |
127259665 |
1 |
O2N3C21H21 |
A2B3C21D21 |
-5.34 |
8.47 |
-9.31 |
-0.89 |
0 |
|
|
338655 |
127259666 |
1 |
O2N3C21H21 |
A2B3C21D21 |
-4.55 |
5.31 |
-9.32 |
-1.2 |
0 |
|
|
338656 |
127259667 |
1 |
NSO2H15C20 |
ABC2D15E20 |
26.74 |
5.16 |
-9.26 |
-1.13 |
0 |
|
|
338657 |
127259668 |
1 |
NOC19H21 |
ABC19D21 |
-10.23 |
4.91 |
-8.62 |
-0.3 |
0 |
|
|
338658 |
127259669 |
1 |
NOC18H19 |
ABC18D19 |
5.72 |
4.69 |
-8.68 |
-0.35 |
0 |
|
|
338659 |
127259670 |
1 |
N2O6C17H18 |
A2B6C17D18 |
-101.37 |
3.79 |
-9.66 |
-1.73 |
0 |
|
|
338660 |
127259671 |
1 |
O2N3H21C22 |
A2B3C21D22 |
6.28 |
7.95 |
-9.34 |
-0.63 |
0 |
|
|
338661 |
127259672 |
1 |
O2N3H19C21 |
A2B3C19D21 |
8.82 |
4.29 |
-9.6 |
-0.82 |
0 |
|
|
338662 |
127259673 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-26.27 |
3.01 |
-9.54 |
-0.93 |
0 |
|
|
338663 |
127259674 |
1 |
O2N3C21H21 |
A2B3C21D21 |
-0.68 |
4.24 |
-9.67 |
-0.78 |
0 |
|
|
338664 |
127259675 |
3 |
NOC8H11 |
ABC8D11 |
-90.03 |
4.38 |
-8.04 |
-0.53 |
0 |
|
|
338665 |
127259676 |
1 |
NSiO3C19H33 |
ABC3D19E33 |
-226.52 |
4.34 |
-9.24 |
0.06 |
0 |
|
|
338666 |
127259677 |
1 |
NO2H19C24 |
AB2C19D24 |
27.22 |
6.64 |
-9.08 |
-0.93 |
0 |
|
|
338667 |
127259678 |
1 |
NO3H21C28 |
AB3C21D28 |
6.02 |
7.01 |
-9.04 |
-0.92 |
0 |
|
|
338668 |
127259679 |
1 |
ClNO2H16C22 |
ABC2D16E22 |
5.04 |
6.36 |
-9.12 |
-0.8 |
0 |
|
|
338669 |
127259680 |
1 |
NO3H17C22 |
AB3C17D22 |
-29.62 |
8.12 |
-9.0 |
-0.81 |
0 |
|
|
338670 |
127259681 |
2 |
NO2H8C11 |
AB2C8D11 |
11.12 |
7.19 |
-9.19 |
-1.54 |
0 |
|
|
338671 |
127259682 |
1 |
N2O2H20C25 |
A2B2C20D25 |
62.1 |
2.39 |
-8.79 |
-0.66 |
0 |