List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
342508 |
127265663 |
1 |
ClFNO3C14H15 |
ABCD3E14F15 |
-167.26 |
3.03 |
-9.71 |
-0.65 |
0 |
|
|
342509 |
127265664 |
1 |
NO3C13H21 |
AB3C13D21 |
-137.88 |
4.95 |
-10.07 |
-0.15 |
0 |
|
|
342510 |
127265665 |
1 |
ON5C19H25 |
AB5C19D25 |
6.69 |
3.51 |
-7.95 |
-0.73 |
0 |
|
|
342511 |
127265666 |
1 |
ON4C20H32 |
AB4C20D32 |
-50.28 |
4.51 |
-7.83 |
0.34 |
0 |
|
|
342512 |
127265667 |
1 |
NO4C14H17 |
AB4C14D17 |
-113.26 |
5.7 |
-9.4 |
-1.01 |
0 |
|
|
342513 |
127265668 |
1 |
NO2C12H15 |
AB2C12D15 |
-60.49 |
4.22 |
-9.38 |
-0.31 |
0 |
|
|
342514 |
127265669 |
1 |
FON2H11C13 |
ABC2D11E13 |
-34.11 |
4.41 |
-9.64 |
-1.21 |
0 |
|
|
342515 |
127265670 |
2 |
ON3C7H9 |
AB3C7D9 |
-22.89 |
2.07 |
-9.18 |
-0.78 |
0 |
|
|
342516 |
127265671 |
1 |
SN2O2C16H22 |
AB2C2D16E22 |
-69.42 |
4.91 |
-8.68 |
-0.39 |
0 |
|
|
342517 |
127265672 |
1 |
S2N3H11C14 |
A2B3C11D14 |
118.05 |
1.44 |
-8.88 |
-1.2 |
0 |
|
|
342518 |
127265673 |
1 |
N2O3C14H14 |
A2B3C14D14 |
-42.94 |
2.6 |
-9.18 |
-1.37 |
0 |
|
|
342519 |
127265674 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-88.3 |
4.75 |
-8.74 |
0.18 |
0 |
|
|
342520 |
127265675 |
1 |
ON4C19H30 |
AB4C19D30 |
-49.14 |
3.21 |
-8.74 |
-0.02 |
0 |
|
|
342522 |
127265677 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-71.41 |
4.4 |
-8.26 |
-0.07 |
0 |
|
|
342523 |
127265678 |
1 |
ON5C15H17 |
AB5C15D17 |
60.41 |
6.44 |
-9.19 |
-0.96 |
0 |
|
|
342524 |
127265679 |
1 |
SN3O3C17H17 |
AB3C3D17E17 |
-29.73 |
7.47 |
-8.95 |
-1.26 |
0 |
|
|
342525 |
127265680 |
1 |
OSN4C14H18 |
ABC4D14E18 |
28.36 |
8.41 |
-8.96 |
-1.31 |
0 |
|
|
342526 |
127265681 |
2 |
ON2C7H8 |
AB2C7D8 |
62.84 |
9.16 |
-9.2 |
-1.65 |
0 |
|
|
342527 |
127265682 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-20.85 |
3.42 |
-8.93 |
0.37 |
0 |
|
|
342528 |
127265683 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-54.62 |
1.82 |
-8.77 |
-0.67 |
0 |
|
|
342529 |
127265684 |
1 |
N7C18H19 |
A7B18C19 |
198.25 |
3.66 |
-9.28 |
-1.08 |
0 |
|
|
342530 |
127265685 |
1 |
FO2N3C16H24 |
AB2C3D16E24 |
-64.69 |
4.92 |
-9.06 |
-0.52 |
0 |
|
|
342531 |
127265686 |
1 |
OS2N3C13H15 |
AB2C3D13E15 |
23.82 |
5.11 |
-9.28 |
-1.7 |
0 |
|
|
342532 |
127265687 |
4 |
NC4H5 |
AB4C5 |
84.41 |
6.61 |
-9.01 |
-0.47 |
0 |
|
|
342533 |
127265688 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-53.68 |
1.79 |
-9.32 |
-0.64 |
0 |
|
|
342534 |
127265689 |
1 |
ON4C15H22 |
AB4C15D22 |
-26.55 |
3.7 |
-8.7 |
-0.25 |
0 |
|
|
342535 |
127265690 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-44.86 |
2.67 |
-8.18 |
0.08 |
0 |
|
|
342536 |
127265691 |
2 |
N2C10H11 |
A2B10C11 |
106.28 |
5.99 |
-9.02 |
-0.77 |
0 |
|
|
342537 |
127265692 |
1 |
ON2C17H20 |
AB2C17D20 |
33.58 |
3.74 |
-8.83 |
-0.04 |
0 |
|
|
342538 |
127265693 |
1 |
SN2O3H16C17 |
AB2C3D16E17 |
-2.29 |
2.61 |
-9.08 |
-0.83 |
0 |
|
|
342539 |
127265694 |
1 |
NO3C17H23 |
AB3C17D23 |
-94.79 |
3.27 |
-8.38 |
0.09 |
0 |
|
|
342540 |
127265695 |
1 |
ON4C13H20 |
AB4C13D20 |
-24.0 |
3.31 |
-9.62 |
-0.34 |
0 |
|
|
342541 |
127265696 |
2 |
ON2C8H10 |
AB2C8D10 |
16.83 |
6.94 |
-9.22 |
-0.41 |
0 |
|
|
342542 |
127265697 |
1 |
N5C15H19 |
A5B15C19 |
76.95 |
5.51 |
-8.28 |
0.12 |
0 |
|
|
342543 |
127265698 |
2 |
NOC9H13 |
ABC9D13 |
-84.61 |
4.19 |
-9.19 |
0.36 |
0 |
|
|
342544 |
127265699 |
1 |
SiN2O2C24H30 |
AB2C2D24E30 |
-62.54 |
5.07 |
-9.04 |
-0.21 |
0 |
|
|
342545 |
127265700 |
2 |
NSC4H6 |
ABC4D6 |
56.63 |
2.45 |
-9.06 |
-1.06 |
0 |
|
|
342546 |
127265701 |
1 |
ON5C17H27 |
AB5C17D27 |
-7.22 |
4.2 |
-8.61 |
0.02 |
0 |
|
|
342547 |
127265702 |
1 |
N5C11H13 |
A5B11C13 |
100.5 |
8.81 |
-9.74 |
-1.1 |
0 |
|
|
342548 |
127265703 |
1 |
N2O3C12H16 |
A2B3C12D16 |
-44.39 |
3.09 |
-9.87 |
-1.25 |
0 |
|
|
342549 |
127265704 |
1 |
BrN2O3C11H13 |
AB2C3D11E13 |
-21.73 |
8.69 |
-9.79 |
-1.78 |
0 |
|
|
342550 |
127265705 |
1 |
NSCl2O2C10H11 |
ABC2D2E10F11 |
-59.51 |
4.86 |
-9.61 |
-0.86 |
0 |
|
|
342551 |
127265706 |
1 |
NSO2C13H19 |
ABC2D13E19 |
-73.36 |
4.24 |
-9.36 |
-1.04 |
0 |
|
|
342552 |
127265707 |
1 |
NO2F3C16H20 |
AB2C3D16E20 |
-221.07 |
4.76 |
-8.68 |
-0.26 |
0 |
|
|
342553 |
127265708 |
1 |
NO2C23H27 |
AB2C23D27 |
-71.6 |
3.62 |
-9.3 |
0.27 |
0 |
|
|
342554 |
127265709 |
1 |
O2S2N3C15H21 |
A2B2C3D15E21 |
-45.73 |
4.99 |
-8.96 |
-0.55 |
0 |
|
|
342555 |
127265710 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-19.05 |
3.98 |
-8.6 |
-0.91 |
0 |
|
|
342556 |
127265711 |
1 |
O2N4C19H20 |
A2B4C19D20 |
7.42 |
7.38 |
-8.73 |
-1.43 |
0 |
|
|
342557 |
127265712 |
1 |
O2N4H12C15 |
A2B4C12D15 |
99.6 |
3.44 |
-9.33 |
-1.9 |
0 |
|
|
342558 |
127265713 |
1 |
SN2O3C16H18 |
AB2C3D16E18 |
-63.87 |
3.65 |
-8.61 |
-0.59 |
0 |
|
|
342559 |
127265714 |
1 |
SN2O3C17H20 |
AB2C3D17E20 |
-65.07 |
5.11 |
-8.55 |
-0.59 |
0 |
|
|
342560 |
127265715 |
1 |
FN2O2C13H13 |
AB2C2D13E13 |
-55.69 |
4.13 |
-9.84 |
-0.89 |
0 |
|
|
342561 |
127265721 |
1 |
SN2O3C15H16 |
AB2C3D15E16 |
-43.8 |
3.92 |
-8.48 |
-0.84 |
0 |
|
|
342562 |
127265722 |
1 |
N3O3C18H19 |
A3B3C18D19 |
18.95 |
1.29 |
-8.52 |
-0.48 |
0 |
|
|
342563 |
127265723 |
2 |
NO2C9H11 |
AB2C9D11 |
-93.78 |
6.4 |
-8.65 |
-0.7 |
0 |
|
|
342564 |
127265724 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-41.81 |
1.19 |
-9.4 |
-0.86 |
0 |
|
|
342565 |
127265725 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-53.37 |
5.59 |
-9.08 |
-0.42 |
0 |
|
|
342566 |
127265726 |
1 |
FNO2C11H12 |
ABC2D11E12 |
-108.81 |
3.95 |
-8.62 |
-0.21 |
0 |
|
|
342567 |
127265727 |
1 |
N3O3C16H19 |
A3B3C16D19 |
-63.91 |
2.92 |
-8.8 |
-0.65 |
0 |
|
|
342568 |
127265728 |
1 |
NO3C15H21 |
AB3C15D21 |
-121.48 |
4.3 |
-9.35 |
-0.18 |
0 |
|
|
342569 |
127265729 |
1 |
ClON5C15H18 |
ABC5D15E18 |
45.61 |
3.94 |
-9.33 |
-0.61 |
0 |
|
|
342570 |
127265730 |
1 |
ON5C15H19 |
AB5C15D19 |
55.17 |
3.95 |
-9.28 |
-0.44 |
0 |
|
|
342571 |
127265731 |
1 |
ClO2N3H8C12 |
AB2C3D8E12 |
70.08 |
4.83 |
-10.28 |
-1.8 |
0 |
|
|
342572 |
127265732 |
1 |
SO2N4H12C16 |
AB2C4D12E16 |
109.97 |
4.32 |
-9.44 |
-1.62 |
0 |
|
|
342573 |
127265733 |
1 |
OSN3H11C14 |
ABC3D11E14 |
83.34 |
1.38 |
-8.95 |
-1.08 |
0 |
|
|
342574 |
127265734 |
2 |
N2H7C8 |
A2B7C8 |
124.38 |
1.92 |
-9.05 |
-1.04 |
0 |
|
|
342575 |
127265735 |
1 |
ON3C17H17 |
AB3C17D17 |
55.35 |
2.59 |
-9.01 |
-0.84 |
0 |
|
|
342576 |
127265736 |
1 |
ClN2O2C15H15 |
AB2C2D15E15 |
-6.99 |
2.27 |
-8.78 |
-0.78 |
0 |
|
|
342577 |
127265737 |
1 |
N2O3C17H18 |
A2B3C17D18 |
-50.95 |
2.73 |
-8.97 |
-0.79 |
0 |
|
|
342578 |
127265738 |
1 |
OSN3H15C17 |
ABC3D15E17 |
78.52 |
1.21 |
-8.87 |
-0.77 |
0 |
|
|
342579 |
127265739 |
1 |
ClO2N3H10C13 |
AB2C3D10E13 |
62.39 |
5.18 |
-10.11 |
-1.6 |
0 |
|
|
342580 |
127265740 |
1 |
OF2N2H14C15 |
AB2C2D14E15 |
-67.18 |
1.42 |
-8.95 |
-0.85 |
0 |
|
|
342581 |
127265741 |
2 |
NOH7C8 |
ABC7D8 |
23.97 |
1.31 |
-8.57 |
-1.1 |
0 |
|
|
342582 |
127265742 |
1 |
FSN3H12C16 |
ABC3D12E16 |
65.74 |
1.31 |
-9.06 |
-1.13 |
0 |
|
|
342583 |
127265743 |
1 |
ON4H14C17 |
AB4C14D17 |
95.53 |
1.72 |
-9.34 |
-0.91 |
0 |