List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
383743 |
134975639 |
2 |
OC6H11 |
AB6C11 |
-110.62 |
0.35 |
-9.97 |
1.53 |
0 |
|
|
383744 |
134975641 |
1 |
ClOC11H19 |
ABC11D19 |
-79.86 |
0.73 |
-9.56 |
0.63 |
0 |
|
|
383745 |
134975643 |
1 |
NC10H19 |
AB10C19 |
-7.77 |
1.57 |
-8.71 |
1.3 |
0 |
|
|
383746 |
134975645 |
1 |
NO2C11H19 |
AB2C11D19 |
-120.98 |
6.0 |
-9.58 |
1.07 |
0 |
|
|
383747 |
134975646 |
1 |
LiNC11H14 |
ABC11D14 |
6.7 |
6.93 |
-7.06 |
1.26 |
0 |
|
|
383748 |
134975647 |
1 |
LiNO3C10H16 |
ABC3D10E16 |
-166.93 |
5.23 |
-7.66 |
0.58 |
0 |
|
|
383749 |
134975648 |
1 |
NO3C10H17 |
AB3C10D17 |
-140.76 |
2.99 |
-9.24 |
0.66 |
0 |
|
|
383750 |
134975650 |
1 |
NOC12H17 |
ABC12D17 |
-15.78 |
2.25 |
-7.82 |
0.44 |
0 |
|
|
383751 |
134975651 |
1 |
LiOSiC6H13 |
ABCD6E13 |
-89.56 |
4.87 |
-7.4 |
1.62 |
0 |
|
|
383752 |
134975655 |
1 |
FCl2O3H9C10 |
AB2C3D9E10 |
-167.21 |
2.87 |
-9.99 |
-1.23 |
0 |
|
|
383753 |
134975656 |
1 |
ClNO4C7H12 |
ABC4D7E12 |
-124.73 |
4.75 |
-11.13 |
-1.05 |
0 |
|
|
383754 |
134975660 |
1 |
SO3C9H10 |
AB3C9D10 |
-66.51 |
5.03 |
-10.08 |
-0.3 |
0 |
|
|
383755 |
134975663 |
1 |
O3C12H16 |
A3B12C16 |
-91.1 |
2.69 |
-9.26 |
0.33 |
0 |
|
|
383756 |
134975664 |
1 |
N3O5C10H15 |
A3B5C10D15 |
-159.71 |
1.22 |
-10.18 |
-0.53 |
0 |
|
|
383757 |
134975668 |
1 |
ClOPSiC11H14 |
ABCDE11F14 |
-142.53 |
2.26 |
-8.27 |
-0.43 |
0 |
|
|
383758 |
134975669 |
1 |
NO2C15H21 |
AB2C15D21 |
-79.23 |
1.41 |
-8.14 |
0.2 |
0 |
|
|
383759 |
134975671 |
2 |
HLiC2 |
ABC2 |
164.81 |
9.44 |
-4.54 |
0.79 |
0 |
|
|
383760 |
134975675 |
1 |
OC9H16 |
AB9C16 |
-65.57 |
1.98 |
-10.3 |
2.83 |
0 |
|
|
383761 |
134975676 |
1 |
SO2C13H18 |
AB2C13D18 |
-68.49 |
5.37 |
-8.96 |
0.1 |
0 |
|
|
383762 |
134975679 |
1 |
OC13H26 |
AB13C26 |
-101.08 |
3.07 |
-9.92 |
0.82 |
0 |
|
|
383763 |
134975680 |
1 |
NO2C15H21 |
AB2C15D21 |
-86.73 |
5.71 |
-9.61 |
-0.07 |
0 |
|
|
383764 |
134975681 |
1 |
NOSiC9H21 |
ABCD9E21 |
-99.86 |
3.72 |
-8.91 |
1.35 |
0 |
|
|
383766 |
134975683 |
1 |
O2C15H22 |
A2B15C22 |
-88.17 |
4.8 |
-9.67 |
-0.25 |
0 |
|
|
383767 |
134975684 |
1 |
LiOC11H21 |
ABC11D21 |
-40.61 |
12.84 |
-6.27 |
0.96 |
0 |
|
|
383768 |
134975685 |
1 |
OC11H22 |
AB11C22 |
-85.02 |
0.64 |
-8.95 |
1.3 |
0 |
|
|
383769 |
134975686 |
1 |
O4C15H24 |
A4B15C24 |
-197.78 |
4.06 |
-9.51 |
-0.34 |
0 |
|
|
383770 |
134975687 |
1 |
NOC11H23 |
ABC11D23 |
-59.44 |
0.61 |
-8.61 |
1.98 |
0 |
|
|
383771 |
134975688 |
1 |
ClNO2H6C9 |
ABC2D6E9 |
-19.54 |
4.59 |
-10.02 |
-1.24 |
0 |
|
|
383772 |
134975689 |
1 |
NOC12H17 |
ABC12D17 |
-37.78 |
1.33 |
-8.42 |
0.62 |
0 |
|
|
383773 |
134975693 |
1 |
SiO2C10H20 |
AB2C10D20 |
-101.54 |
2.01 |
-8.11 |
0.48 |
0 |
|
|
383774 |
134975694 |
1 |
BrNO4C11H20 |
ABC4D11E20 |
-211.08 |
2.62 |
-10.26 |
-0.96 |
0 |
|
|
383775 |
134975698 |
4 |
OC3H3 |
AB3C3 |
-144.87 |
3.99 |
-9.38 |
-0.41 |
0 |
|
|
383776 |
134975699 |
1 |
ClON4C12H13 |
ABC4D12E13 |
37.23 |
5.0 |
-10.11 |
-1.28 |
0 |
|
|
383777 |
134975700 |
1 |
PWO6H17C19 |
ABC6D17E19 |
-141.88 |
7.17 |
-7.57 |
-0.19 |
0 |
|
|
383780 |
134975709 |
1 |
OSeC14H20 |
ABC14D20 |
-31.73 |
3.2 |
-8.48 |
-0.34 |
0 |
|
|
383781 |
134975711 |
1 |
LiO2C7H11 |
AB2C7D11 |
-84.54 |
5.83 |
-6.53 |
1.96 |
0 |
|
|
383782 |
134975712 |
1 |
MgN2C4H12 |
AB2C4D12 |
-5.94 |
3.16 |
-8.2 |
0.87 |
0 |
|
|
383783 |
134975713 |
1 |
LiC7H9 |
AB7C9 |
101.53 |
6.36 |
-8.17 |
3.62 |
0 |
|
|
383784 |
134975714 |
1 |
LiC9H15 |
AB9C15 |
10.75 |
6.53 |
-7.24 |
2.13 |
0 |
|
|
383785 |
134975715 |
1 |
LiH2O2F3C7 |
AB2C2D3E7 |
-175.54 |
6.44 |
-8.25 |
-0.89 |
0 |
|
|
383786 |
134975716 |
1 |
OSiC12H22 |
ABC12D22 |
-97.78 |
0.58 |
-8.92 |
1.19 |
0 |
|
|
383787 |
134975717 |
2 |
OC6H9 |
AB6C9 |
-95.48 |
2.33 |
-10.01 |
0.67 |
0 |
|
|
383788 |
134975721 |
1 |
NC8H17 |
AB8C17 |
-22.34 |
1.73 |
-8.41 |
1.54 |
0 |
|
|
383789 |
134975722 |
1 |
NOSSiC13H23 |
ABCDE13F23 |
-83.68 |
4.63 |
-8.65 |
-0.21 |
0 |
|
|
383790 |
134975723 |
1 |
NOSeC15H21 |
ABCD15E21 |
-26.02 |
5.91 |
-7.58 |
-0.09 |
0 |
|
|
383791 |
134975724 |
1 |
LiO2C6H9 |
AB2C6D9 |
-118.8 |
3.79 |
-7.49 |
2.25 |
0 |
|
|
383792 |
134975726 |
1 |
BrClC11H20 |
ABC11D20 |
-36.15 |
2.65 |
-9.94 |
-0.23 |
0 |
|
|
383793 |
134975727 |
1 |
O2Cl3C9H15 |
A2B3C9D15 |
-148.82 |
2.69 |
-11.11 |
-0.54 |
0 |
|
|
383794 |
134975728 |
3 |
OC5H6 |
AB5C6 |
-91.29 |
2.01 |
-9.44 |
0.21 |
0 |
|
|
383795 |
134975730 |
1 |
O2F3C10H13 |
A2B3C10D13 |
-237.96 |
5.04 |
-10.88 |
-0.18 |
0 |