List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
336650 |
127255657 |
1 |
BNO6C16H28 |
ABC6D16E28 |
-382.9 |
6.69 |
-9.74 |
0.25 |
0 |
|
|
336651 |
127255658 |
1 |
BrClNC11H15 |
ABCD11E15 |
-21.27 |
5.77 |
-9.6 |
-0.35 |
0 |
|
|
336652 |
127255659 |
2 |
NO2C5H6 |
AB2C5D6 |
-73.25 |
4.64 |
-10.93 |
-1.92 |
0 |
|
|
336653 |
127255660 |
1 |
BN3O4C22H36 |
AB3C4D22E36 |
-255.06 |
3.86 |
-9.25 |
0.65 |
0 |
|
|
336654 |
127255661 |
1 |
BN3O4C22H36 |
AB3C4D22E36 |
-252.6 |
1.92 |
-9.26 |
0.68 |
0 |
|
|
336655 |
127255662 |
1 |
BrFNO2C11H11 |
ABCD2E11F11 |
-111.44 |
5.56 |
-9.86 |
-0.67 |
0 |
|
|
336656 |
127255663 |
1 |
BrClN2O2C12H18 |
ABC2D2E12F18 |
-126.37 |
2.69 |
-10.09 |
-1.03 |
0 |
|
|
336657 |
127255664 |
1 |
BrSN2O3H7C8 |
ABC2D3E7F8 |
-61.66 |
2.37 |
-9.6 |
-1.36 |
0 |
|
|
336658 |
127255665 |
1 |
SO3C7H8 |
AB3C7D8 |
-108.21 |
3.34 |
-9.53 |
-1.23 |
0 |
|
|
336659 |
127255666 |
1 |
ClNOC10H16 |
ABCD10E16 |
-68.59 |
0.92 |
-9.7 |
-0.05 |
0 |
|
|
336660 |
127255667 |
1 |
NC19H21 |
AB19C21 |
110.37 |
1.22 |
-8.78 |
0.2 |
0 |
|
|
336661 |
127255668 |
1 |
OCl2H14C16 |
AB2C14D16 |
-23.16 |
4.17 |
-9.29 |
-0.38 |
0 |
|
|
336662 |
127255669 |
1 |
BrNH8C10 |
ABC8D10 |
45.64 |
4.08 |
-9.84 |
-1.08 |
0 |
|
|
336663 |
127255670 |
1 |
BrO3C11H11 |
AB3C11D11 |
-87.67 |
5.93 |
-8.8 |
-0.7 |
0 |
|
|
336664 |
127255671 |
1 |
BrOH9C10 |
ABC9D10 |
-8.94 |
3.47 |
-8.88 |
-0.47 |
0 |
|
|
336665 |
127255672 |
1 |
BrSH9C10 |
ABC9D10 |
23.04 |
3.24 |
-8.67 |
-0.58 |
0 |
|
|
336667 |
127255674 |
1 |
ClFNOC7H9 |
ABCDE7F9 |
-102.86 |
4.7 |
-9.56 |
-0.34 |
0 |
|
|
336668 |
127255675 |
1 |
BrNO5C8H18 |
ABC5D8E18 |
-250.75 |
2.96 |
-9.63 |
0.32 |
0 |
|
|
336669 |
127255676 |
1 |
ClO7N8C25H41 |
AB7C8D25E41 |
-287.46 |
5.48 |
-9.59 |
-1.37 |
0 |
|
|
336670 |
127255677 |
1 |
BFNO2H13C18 |
ABCD2E13F18 |
-119.6 |
5.19 |
-8.56 |
-0.64 |
0 |
|
|
336671 |
127255678 |
1 |
OBr2H6C9 |
AB2C6D9 |
-9.81 |
1.58 |
-10.03 |
-1.18 |
0 |
|
|
336672 |
127255679 |
1 |
OBr2H6C9 |
AB2C6D9 |
-7.8 |
5.01 |
-9.76 |
-1.08 |
0 |
|
|
336673 |
127255680 |
1 |
ClIOH6C9 |
ABCD6E9 |
-4.65 |
1.52 |
-9.8 |
-1.37 |
0 |
|
|
336674 |
127255681 |
1 |
ClIOH6C9 |
ABCD6E9 |
-8.05 |
2.5 |
-9.65 |
-1.27 |
0 |
|
|
336675 |
127255682 |
1 |
ClIOH6C9 |
ABCD6E9 |
-5.93 |
2.8 |
-9.55 |
-1.18 |
0 |
|
|
336676 |
127255683 |
1 |
ClIOH6C9 |
ABCD6E9 |
-5.77 |
3.44 |
-9.62 |
-1.28 |
0 |
|
|
336677 |
127255684 |
1 |
ClIOH6C9 |
ABCD6E9 |
-6.91 |
3.56 |
-9.76 |
-1.22 |
0 |
|
|
336678 |
127255685 |
1 |
ClIOH6C9 |
ABCD6E9 |
-2.07 |
4.75 |
-9.53 |
-1.19 |
0 |
|
|
336679 |
127255686 |
1 |
FIOH6C9 |
ABCD6E9 |
-44.09 |
1.43 |
-9.81 |
-1.33 |
0 |
|
|
336680 |
127255687 |
1 |
FIOH6C9 |
ABCD6E9 |
-44.99 |
2.47 |
-9.69 |
-1.26 |
0 |
|
|
336681 |
127255688 |
1 |
FIOH6C9 |
ABCD6E9 |
-42.94 |
2.78 |
-9.6 |
-1.15 |
0 |
|
|
336682 |
127255689 |
1 |
FIOH6C9 |
ABCD6E9 |
-45.45 |
3.59 |
-9.79 |
-1.22 |
0 |
|
|
336683 |
127255690 |
1 |
FIOH6C9 |
ABCD6E9 |
-42.53 |
4.72 |
-9.59 |
-1.16 |
0 |
|
|
336684 |
127255691 |
1 |
BrIOH6C9 |
ABCD6E9 |
5.15 |
1.59 |
-9.84 |
-1.41 |
0 |
|
|
336685 |
127255692 |
1 |
BrIOH6C9 |
ABCD6E9 |
5.29 |
2.88 |
-9.62 |
-1.23 |
0 |
|
|
336686 |
127255693 |
1 |
BrIOH6C9 |
ABCD6E9 |
8.26 |
4.75 |
-9.46 |
-1.23 |
0 |
|
|
336687 |
127255694 |
1 |
ClIOH6C9 |
ABCD6E9 |
-9.02 |
3.1 |
-9.72 |
-1.36 |
0 |
|
|
336688 |
127255695 |
1 |
ClIOH6C9 |
ABCD6E9 |
-8.69 |
3.43 |
-9.61 |
-1.28 |
0 |
|
|
336689 |
127255696 |
1 |
ClIOH6C9 |
ABCD6E9 |
-7.53 |
3.88 |
-9.86 |
-1.34 |
0 |
|
|
336690 |
127255697 |
1 |
ClIOH6C9 |
ABCD6E9 |
-4.51 |
4.9 |
-9.54 |
-1.22 |
0 |
|
|
336691 |
127255698 |
1 |
FIOH6C9 |
ABCD6E9 |
-47.91 |
1.97 |
-9.82 |
-1.33 |
0 |
|
|
336692 |
127255699 |
1 |
FIOH6C9 |
ABCD6E9 |
-46.45 |
3.05 |
-9.82 |
-1.35 |
0 |
|
|
336693 |
127255700 |
1 |
FIOH6C9 |
ABCD6E9 |
-47.17 |
3.76 |
-9.76 |
-1.3 |
0 |
|
|
336694 |
127255701 |
1 |
FIOH6C9 |
ABCD6E9 |
-44.71 |
3.83 |
-9.75 |
-1.33 |
0 |
|
|
336695 |
127255702 |
1 |
FIOH6C9 |
ABCD6E9 |
-45.87 |
4.18 |
-9.94 |
-1.38 |
0 |
|
|
336696 |
127255703 |
1 |
FIOH6C9 |
ABCD6E9 |
-45.23 |
5.23 |
-9.62 |
-1.22 |
0 |
|
|
336697 |
127255704 |
1 |
BrIOH6C9 |
ABCD6E9 |
4.41 |
1.88 |
-9.84 |
-1.4 |
0 |
|
|
336698 |
127255705 |
1 |
BrIOH6C9 |
ABCD6E9 |
5.73 |
3.75 |
-9.77 |
-1.41 |
0 |
|
|
336699 |
127255706 |
1 |
BrIOH6C9 |
ABCD6E9 |
6.69 |
4.93 |
-9.6 |
-1.25 |
0 |
|
|
336700 |
127255707 |
1 |
IOH9C10 |
ABC9D10 |
-8.21 |
3.52 |
-9.6 |
-1.06 |
0 |
|
|
336701 |
127255708 |
1 |
IOH9C10 |
ABC9D10 |
-9.03 |
4.87 |
-9.39 |
-0.96 |
0 |
|
|
336702 |
127255709 |
1 |
IOH9C10 |
ABC9D10 |
-6.44 |
5.31 |
-9.29 |
-0.86 |
0 |
|
|
336703 |
127255710 |
1 |
IOH9C10 |
ABC9D10 |
-8.53 |
5.3 |
-9.48 |
-0.89 |
0 |
|
|
336704 |
127255711 |
1 |
IOH9C10 |
ABC9D10 |
-5.9 |
4.39 |
-9.32 |
-0.86 |
0 |
|
|
336705 |
127255712 |
1 |
FOC11H11 |
ABC11D11 |
-77.52 |
3.44 |
-9.91 |
-0.67 |
0 |
|
|
336706 |
127255713 |
1 |
FOC11H11 |
ABC11D11 |
-76.99 |
4.88 |
-9.64 |
-0.79 |
0 |
|
|
336707 |
127255714 |
1 |
FOC11H11 |
ABC11D11 |
-76.47 |
5.6 |
-9.67 |
-0.69 |
0 |
|
|
336708 |
127255715 |
1 |
ClOC11H11 |
ABC11D11 |
-39.75 |
3.4 |
-9.75 |
-0.79 |
0 |
|
|
336709 |
127255716 |
1 |
ClOC11H11 |
ABC11D11 |
-39.3 |
4.95 |
-9.48 |
-0.79 |
0 |
|
|
336710 |
127255717 |
1 |
ClOC11H11 |
ABC11D11 |
-38.22 |
5.44 |
-9.42 |
-0.71 |
0 |
|
|
336711 |
127255718 |
1 |
BrOC11H11 |
ABC11D11 |
-26.05 |
5.45 |
-9.51 |
-0.74 |
0 |
|
|
336712 |
127255719 |
1 |
IOC11H11 |
ABC11D11 |
-14.47 |
4.61 |
-9.39 |
-0.93 |
0 |
|
|
336713 |
127255720 |
1 |
BrO2H9C10 |
AB2C9D10 |
-47.94 |
3.75 |
-9.3 |
-0.94 |
0 |
|
|
336714 |
127255721 |
1 |
BrO2H9C10 |
AB2C9D10 |
-52.11 |
5.02 |
-9.25 |
-0.91 |
0 |
|
|
336715 |
127255722 |
1 |
IO2H9C10 |
AB2C9D10 |
-34.4 |
3.89 |
-9.18 |
-0.98 |
0 |
|
|
336716 |
127255723 |
1 |
IO2H9C10 |
AB2C9D10 |
-37.74 |
4.94 |
-9.2 |
-1.05 |
0 |
|
|
336717 |
127255724 |
1 |
IO2H9C10 |
AB2C9D10 |
-40.12 |
6.57 |
-9.46 |
-0.95 |
0 |
|
|
336718 |
127255725 |
1 |
IO2H9C10 |
AB2C9D10 |
-34.78 |
5.4 |
-8.95 |
-0.83 |
0 |
|
|
336719 |
127255726 |
1 |
FNOH8C9 |
ABCD8E9 |
-62.64 |
3.87 |
-8.97 |
-0.74 |
0 |
|
|
336720 |
127255727 |
1 |
FNOH8C9 |
ABCD8E9 |
-64.94 |
5.5 |
-8.97 |
-0.79 |
0 |
|
|
336721 |
127255728 |
1 |
FNOH8C9 |
ABCD8E9 |
-62.58 |
5.86 |
-8.87 |
-0.78 |
0 |
|
|
336722 |
127255729 |
1 |
FNOH8C9 |
ABCD8E9 |
-65.51 |
5.65 |
-8.92 |
-0.56 |
0 |
|
|
336723 |
127255730 |
1 |
FNOH8C9 |
ABCD8E9 |
-70.49 |
7.04 |
-9.1 |
-0.33 |
0 |
|
|
336724 |
127255731 |
1 |
FNOH8C9 |
ABCD8E9 |
-61.44 |
4.75 |
-8.77 |
-0.74 |
0 |
|
|
336725 |
127255732 |
1 |
ClNOH8C9 |
ABCD8E9 |
-25.94 |
3.95 |
-8.91 |
-0.83 |
0 |