List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
372642 |
131301437 |
1 |
ClSN3O4H6C8 |
ABC3D4E6F8 |
-21.63 |
3.27 |
-10.46 |
-2.45 |
0 |
|
|
372643 |
131301438 |
1 |
ClSN3O4H6C8 |
ABC3D4E6F8 |
-21.25 |
5.55 |
-10.55 |
-2.6 |
0 |
|
|
372644 |
131301520 |
1 |
ClNOF2C10H12 |
ABCD2E10F12 |
-133.07 |
2.6 |
-9.7 |
-0.99 |
0 |
|
|
372645 |
131301522 |
1 |
NO3C12H15 |
AB3C12D15 |
-108.36 |
2.0 |
-8.62 |
-0.07 |
0 |
|
|
372646 |
131301534 |
1 |
ClINOH7C9 |
ABCDE7F9 |
0.59 |
2.9 |
-9.8 |
-1.5 |
0 |
|
|
372647 |
131301559 |
1 |
INO2C11H14 |
ABC2D11E14 |
-60.17 |
3.45 |
-9.21 |
-0.92 |
0 |
|
|
372648 |
131301560 |
1 |
BrN2O2C11H11 |
AB2C2D11E11 |
-30.38 |
4.42 |
-9.7 |
-1.16 |
0 |
|
|
372649 |
131301582 |
1 |
N3C12H13 |
A3B12C13 |
49.76 |
6.77 |
-7.95 |
-0.24 |
0 |
|
|
372650 |
131301598 |
1 |
O2N3C5H11 |
A2B3C5D11 |
-92.1 |
5.63 |
-9.53 |
0.74 |
0 |
|
|
372651 |
131301602 |
1 |
O2N3C6H13 |
A2B3C6D13 |
-90.53 |
2.41 |
-9.34 |
0.9 |
0 |
|
|
372652 |
131301603 |
1 |
O2N3C5H11 |
A2B3C5D11 |
-90.28 |
4.14 |
-9.43 |
0.74 |
0 |
|
|
372653 |
131301611 |
1 |
N3F4C7H9 |
A3B4C7D9 |
-163.95 |
4.33 |
-9.77 |
0.33 |
0 |
|
|
372654 |
131301623 |
1 |
NSF3O3C7H12 |
ABC3D3E7F12 |
-300.27 |
4.68 |
-10.05 |
0.26 |
0 |
|
|
372655 |
131301642 |
1 |
NOF3C10H12 |
ABC3D10E12 |
-163.94 |
4.6 |
-9.71 |
-0.32 |
0 |
|
|
372656 |
131301645 |
1 |
INOC11H14 |
ABCD11E14 |
-26.34 |
2.9 |
-9.32 |
-0.86 |
0 |
|
|
372657 |
131301688 |
1 |
NO3C11H11 |
AB3C11D11 |
-70.09 |
3.9 |
-8.91 |
-0.55 |
0 |
|
|
372658 |
131301714 |
2 |
ON2C5H6 |
AB2C5D6 |
-19.24 |
5.08 |
-9.29 |
-1.0 |
0 |
|
|
372659 |
131301722 |
1 |
INF2O2H6C9 |
ABC2D2E6F9 |
-118.01 |
3.54 |
-9.93 |
-1.53 |
0 |
|
|
372660 |
131301740 |
1 |
ON2C11H14 |
AB2C11D14 |
5.87 |
2.13 |
-8.59 |
0.68 |
0 |
|
|
372661 |
131301748 |
1 |
ClON3C11H14 |
ABC3D11E14 |
-3.23 |
3.01 |
-8.89 |
-0.68 |
0 |
|
|
372662 |
131301772 |
1 |
NSO2C12H17 |
ABC2D12E17 |
-60.64 |
3.06 |
-8.16 |
-0.19 |
0 |
|
|
372663 |
131301778 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-40.08 |
4.66 |
-9.96 |
-1.31 |
0 |
|
|
372664 |
131301780 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-69.53 |
4.12 |
-8.88 |
-0.36 |
0 |
|
|
372665 |
131301793 |
1 |
ClN3H8C10 |
AB3C8D10 |
67.65 |
2.04 |
-8.8 |
-0.89 |
0 |
|
|
372666 |
131301802 |
1 |
BrN2C10H11 |
AB2C10D11 |
36.29 |
1.24 |
-8.83 |
-0.22 |
0 |
|
|
372667 |
131301825 |
1 |
NO4C11H11 |
AB4C11D11 |
-109.64 |
2.15 |
-8.57 |
-0.92 |
0 |
|
|
372668 |
131301840 |
1 |
INSO2H6C11 |
ABCD2E6F11 |
2.58 |
4.21 |
-9.22 |
-1.52 |
0 |
|
|
372669 |
131301853 |
1 |
BrNOF4H6C8 |
ABCD4E6F8 |
-196.73 |
1.79 |
-10.13 |
-0.94 |
0 |
|
|
372670 |
131301862 |
1 |
NF2C12H15 |
AB2C12D15 |
-86.5 |
1.77 |
-9.07 |
-0.09 |
0 |
|
|
372671 |
131301863 |
1 |
IN2O3C9H11 |
AB2C3D9E11 |
-17.1 |
4.47 |
-9.74 |
-1.81 |
0 |
|
|
372672 |
131301901 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-52.69 |
2.79 |
-9.13 |
-0.35 |
0 |
|
|
372673 |
131301928 |
1 |
FNO2C12H14 |
ABC2D12E14 |
-125.6 |
4.25 |
-8.74 |
0.03 |
0 |
|
|
372674 |
131301930 |
1 |
N3O3C8H9 |
A3B3C8D9 |
-91.38 |
4.11 |
-8.8 |
-0.1 |
0 |
|
|
372675 |
131301954 |
1 |
N2O2S2H8C9 |
A2B2C2D8E9 |
26.17 |
7.77 |
-8.86 |
-1.16 |
0 |
|
|
372676 |
131301971 |
1 |
FSO3H7C11 |
ABC3D7E11 |
-122.48 |
5.76 |
-9.4 |
-1.41 |
0 |
|
|
372677 |
131302014 |
1 |
BrNSO2C6H6 |
ABCD2E6F6 |
-55.87 |
1.47 |
-9.67 |
-1.11 |
0 |
|
|
372678 |
131302018 |
1 |
BrNH10C11 |
ABC10D11 |
64.65 |
4.11 |
-9.87 |
-0.44 |
0 |
|
|
372679 |
131302022 |
3 |
NOC3H3 |
ABC3D3 |
-48.78 |
9.47 |
-9.58 |
-1.73 |
0 |
|
|
372680 |
131302031 |
1 |
NO3C11H15 |
AB3C11D15 |
-84.28 |
5.94 |
-9.31 |
-0.94 |
0 |
|
|
372681 |
131302055 |
1 |
SO4H10C11 |
AB4C10D11 |
-147.38 |
6.4 |
-9.16 |
-0.91 |
0 |
|
|
372682 |
131302090 |
1 |
SN3C8H11 |
AB3C8D11 |
40.67 |
2.77 |
-9.38 |
-0.41 |
0 |
|
|
372683 |
131302099 |
1 |
ON2H12C13 |
AB2C12D13 |
24.36 |
7.76 |
-8.74 |
-1.4 |
0 |
|
|
372684 |
131302122 |
1 |
NS2C8H13 |
AB2C8D13 |
6.72 |
1.73 |
-8.07 |
0.05 |
0 |
|
|
372685 |
131302144 |
1 |
O3C13H20 |
A3B13C20 |
-161.29 |
4.26 |
-9.72 |
0.6 |
0 |
|
|
372686 |
131302534 |
2 |
NOC6H7 |
ABC6D7 |
-41.38 |
1.29 |
-8.28 |
-0.16 |
0 |
|
|
372687 |
131302556 |
1 |
N2O3C10H10 |
A2B3C10D10 |
-60.08 |
4.79 |
-8.77 |
-0.75 |
0 |
|
|
372688 |
131302559 |
1 |
N2O3C10H10 |
A2B3C10D10 |
-75.92 |
5.02 |
-9.42 |
-1.09 |
0 |
|
|
372689 |
131302582 |
1 |
N2O4H6C9 |
A2B4C6D9 |
-5.94 |
1.99 |
-10.31 |
-2.28 |
0 |
|
|
372690 |
131302591 |
2 |
NO2H4C5 |
AB2C4D5 |
-20.01 |
7.5 |
-10.22 |
-1.66 |
0 |
|
|
372691 |
131302620 |
1 |
ClON2H9C11 |
ABC2D9E11 |
12.1 |
0.31 |
-9.39 |
-1.01 |
0 |