List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
271650 |
103687631 |
1 |
NO3H11C15 |
AB3C11D15 |
-27.77 |
3.54 |
-8.89 |
-1.1 |
0 |
|
|
271651 |
103687660 |
1 |
NO5C14H17 |
AB5C14D17 |
-199.04 |
5.22 |
-8.7 |
-0.7 |
0 |
|
|
271652 |
103687666 |
1 |
NO4C15H15 |
AB4C15D15 |
-125.93 |
1.88 |
-8.82 |
-1.04 |
0 |
|
|
271653 |
103687670 |
1 |
NO4H15C16 |
AB4C15D16 |
-125.97 |
1.55 |
-8.75 |
-0.87 |
0 |
|
|
271654 |
103687676 |
1 |
FNO3H14C15 |
ABC3D14E15 |
-128.97 |
3.27 |
-8.74 |
-0.75 |
0 |
|
|
271655 |
103687681 |
1 |
BrNSO3H12C13 |
ABCD3E12F13 |
-73.04 |
2.75 |
-8.7 |
-0.79 |
0 |
|
|
271656 |
103687682 |
1 |
SN2O3C13H14 |
AB2C3D13E14 |
-85.49 |
3.44 |
-8.89 |
-1.12 |
0 |
|
|
271657 |
103687691 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-104.71 |
2.49 |
-8.77 |
-1.01 |
0 |
|
|
271658 |
103687692 |
1 |
NO3C12H15 |
AB3C12D15 |
-93.48 |
3.78 |
-8.65 |
-0.75 |
0 |
|
|
271659 |
103687700 |
1 |
NO4C14H19 |
AB4C14D19 |
-162.14 |
4.34 |
-8.58 |
-0.65 |
0 |
|
|
271660 |
103687708 |
1 |
NSO3C13H13 |
ABC3D13E13 |
-91.86 |
2.23 |
-8.76 |
-0.86 |
0 |
|
|
271661 |
103687720 |
2 |
NO2C7H9 |
AB2C7D9 |
-167.38 |
4.09 |
-8.81 |
-0.88 |
0 |
|
|
271662 |
103687732 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-94.79 |
2.85 |
-8.67 |
-0.76 |
0 |
|
|
271663 |
103687738 |
1 |
N2O3C17H32 |
A2B3C17D32 |
-193.25 |
6.01 |
-9.07 |
1.01 |
0 |
|
|
271664 |
103687739 |
1 |
SN2O3C9H18 |
AB2C3D9E18 |
-147.31 |
3.57 |
-9.73 |
0.64 |
0 |
|
|
271665 |
103687766 |
1 |
ON4C14H20 |
AB4C14D20 |
-3.22 |
2.29 |
-8.85 |
-0.82 |
0 |
|
|
271666 |
103687768 |
1 |
N3O3C12H17 |
A3B3C12D17 |
-46.91 |
8.74 |
-9.3 |
-1.03 |
0 |
|
|
271667 |
103687775 |
1 |
O3N4C11H18 |
A3B4C11D18 |
-39.51 |
8.35 |
-9.3 |
-0.7 |
0 |
|
|
271668 |
103687807 |
1 |
BrSN4H9C11 |
ABC4D9E11 |
107.08 |
5.6 |
-9.33 |
-1.21 |
0 |
|
|
271669 |
103687826 |
1 |
OSN4C11H20 |
ABC4D11E20 |
-16.19 |
2.32 |
-8.59 |
0.25 |
0 |
|
|
271670 |
103687827 |
1 |
OSN4C14H16 |
ABC4D14E16 |
48.8 |
9.51 |
-9.08 |
-1.2 |
0 |
|
|
271671 |
103687839 |
1 |
N2O4C17H20 |
A2B4C17D20 |
-156.18 |
1.23 |
-9.45 |
-0.84 |
0 |
|
|
271672 |
103687866 |
1 |
BrON2H15C16 |
ABC2D15E16 |
42.07 |
3.53 |
-8.55 |
-0.66 |
0 |
|
|
271673 |
103687882 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-48.77 |
4.99 |
-8.6 |
-0.6 |
0 |
|
|
271674 |
103687883 |
1 |
BrON2H15C16 |
ABC2D15E16 |
38.84 |
4.97 |
-8.63 |
-0.73 |
0 |
|
|
271675 |
103687918 |
1 |
BrN4C9H11 |
AB4C9D11 |
82.69 |
5.49 |
-9.33 |
0.04 |
0 |
|
|
271676 |
103687922 |
1 |
BrNOC13H14 |
ABCD13E14 |
-17.25 |
3.88 |
-8.94 |
-0.18 |
0 |
|
|
271677 |
103687943 |
1 |
ClNO2C12H18 |
ABC2D12E18 |
-85.62 |
2.88 |
-9.66 |
-0.61 |
0 |
|
|
271678 |
103687995 |
1 |
FSN2O2H11C14 |
ABC2D2E11F14 |
-48.07 |
3.84 |
-9.46 |
-1.33 |
0 |
|
|
271679 |
103688016 |
1 |
FSN2O2H13C15 |
ABC2D2E13F15 |
-60.92 |
3.83 |
-9.03 |
-1.5 |
0 |
|
|
271680 |
103688043 |
1 |
SN2O2F3C12H13 |
AB2C2D3E12F13 |
-197.7 |
4.08 |
-10.18 |
-1.5 |
0 |
|
|
271681 |
103688058 |
1 |
ClFSN2O2H10C14 |
ABCD2E2F10G14 |
-61.95 |
2.15 |
-9.3 |
-1.6 |
0 |
|
|
271682 |
103688072 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-97.17 |
3.64 |
-9.31 |
-0.65 |
0 |
|
|
271683 |
103688073 |
1 |
ClIN2O2C12H12 |
ABC2D2E12F12 |
-44.98 |
2.37 |
-9.7 |
-1.5 |
0 |
|
|
271684 |
103688084 |
1 |
ClN2O3C10H11 |
AB2C3D10E11 |
-86.33 |
1.45 |
-9.67 |
-0.82 |
0 |
|
|
271685 |
103688100 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-29.25 |
3.64 |
-9.56 |
-1.18 |
0 |
|
|
271686 |
103688370 |
1 |
BrFSN3H9C10 |
ABCD3E9F10 |
25.17 |
3.46 |
-9.22 |
-0.91 |
0 |
|
|
271687 |
103688417 |
1 |
NOF4C11H13 |
ABC4D11E13 |
-246.44 |
6.53 |
-9.04 |
-0.63 |
0 |
|
|
271688 |
103688430 |
1 |
BrOS2N3C8H8 |
ABC2D3E8F8 |
40.67 |
4.96 |
-9.32 |
-1.25 |
0 |
|
|
271689 |
103688492 |
1 |
ON2C16H22 |
AB2C16D22 |
-6.35 |
3.43 |
-8.46 |
0.54 |
0 |
|
|
271690 |
103688618 |
1 |
SN2C12H14 |
AB2C12D14 |
55.46 |
3.72 |
-8.4 |
-0.45 |
0 |
|
|
271691 |
103688644 |
1 |
N4C9H12 |
A4B9C12 |
70.04 |
5.62 |
-9.27 |
0.42 |
0 |
|
|
271692 |
103688785 |
1 |
SN2O2C13H18 |
AB2C2D13E18 |
-56.32 |
4.19 |
-10.2 |
-1.29 |
0 |
|
|
271693 |
103688786 |
1 |
SN2O3C13H18 |
AB2C3D13E18 |
-83.41 |
5.17 |
-9.96 |
-1.3 |
0 |
|
|
271694 |
103689105 |
1 |
SN2O4C13H16 |
AB2C4D13E16 |
-121.09 |
3.36 |
-9.78 |
-1.38 |
0 |
|
|
271695 |
103689126 |
1 |
SN3O3C13H13 |
AB3C3D13E13 |
-35.63 |
3.91 |
-9.96 |
-1.62 |
0 |
|
|
271696 |
103689249 |
1 |
N2O2C19H36 |
A2B2C19D36 |
-158.2 |
1.86 |
-8.84 |
1.01 |
0 |
|
|
271697 |
103689322 |
1 |
SO2N3H13C14 |
AB2C3D13E14 |
-7.51 |
3.2 |
-9.22 |
-1.5 |
0 |
|
|
271698 |
103689323 |
1 |
SO2N3H13C14 |
AB2C3D13E14 |
-4.7 |
2.96 |
-9.02 |
-1.48 |
0 |
|
|
271699 |
103689328 |
1 |
SN2C8H12 |
AB2C8D12 |
24.53 |
2.88 |
-8.37 |
-0.16 |
0 |