List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
291600 |
113446369 |
1 |
N4C13H16 |
A4B13C16 |
70.62 |
3.64 |
-8.51 |
-0.44 |
0 |
|
|
291601 |
113446375 |
1 |
ON5C12H15 |
AB5C12D15 |
26.82 |
2.46 |
-8.87 |
-0.77 |
0 |
|
|
291602 |
113446462 |
1 |
N5C13H19 |
A5B13C19 |
64.28 |
3.77 |
-8.22 |
-0.32 |
0 |
|
|
291603 |
113446495 |
1 |
N5C12H17 |
A5B12C17 |
65.22 |
2.17 |
-8.65 |
-0.64 |
0 |
|
|
291604 |
113447169 |
2 |
NF2C6H7 |
AB2C6D7 |
-191.42 |
0.13 |
-9.9 |
-0.54 |
0 |
|
|
291605 |
113447172 |
1 |
BrClFN2H11C13 |
ABCD2E11F13 |
3.89 |
3.62 |
-9.7 |
-0.6 |
0 |
|
|
291606 |
113447433 |
1 |
N4C13H20 |
A4B13C20 |
47.55 |
2.47 |
-8.49 |
0.0 |
0 |
|
|
291607 |
113447435 |
1 |
FN3C13H14 |
AB3C13D14 |
13.25 |
1.96 |
-8.48 |
-0.16 |
0 |
|
|
291608 |
113447462 |
1 |
SN4C12H16 |
AB4C12D16 |
57.2 |
2.97 |
-8.57 |
-0.59 |
0 |
|
|
291609 |
113447711 |
1 |
N3O3C12H17 |
A3B3C12D17 |
-116.94 |
6.49 |
-9.1 |
-0.68 |
0 |
|
|
291610 |
113447828 |
1 |
SN3H11C13 |
AB3C11D13 |
70.81 |
2.71 |
-8.42 |
-0.97 |
0 |
|
|
291611 |
113447951 |
1 |
N2C15H30 |
A2B15C30 |
-40.32 |
2.62 |
-8.27 |
2.76 |
0 |
|
|
291612 |
113448020 |
1 |
N2C15H30 |
A2B15C30 |
-11.78 |
2.56 |
-8.5 |
2.52 |
0 |
|
|
291613 |
113448283 |
2 |
NC8H16 |
AB8C16 |
-37.33 |
0.82 |
-8.14 |
2.76 |
0 |
|
|
291614 |
113448319 |
1 |
ON3C13H27 |
AB3C13D27 |
-56.53 |
0.64 |
-8.73 |
2.38 |
0 |
|
|
291615 |
113449491 |
1 |
SN3C14H23 |
AB3C14D23 |
15.95 |
1.41 |
-8.76 |
-0.57 |
0 |
|
|
291616 |
113449598 |
1 |
BrNOC15H20 |
ABCD15E20 |
-13.81 |
3.72 |
-8.79 |
-0.08 |
0 |
|
|
291617 |
113449614 |
1 |
FSO2C14H17 |
ABC2D14E17 |
-109.82 |
4.31 |
-8.61 |
-0.35 |
0 |
|
|
291618 |
113449710 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-24.36 |
6.66 |
-8.55 |
-1.0 |
0 |
|
|
291619 |
113450159 |
1 |
ClN2O2C13H19 |
AB2C2D13E19 |
-88.77 |
5.2 |
-8.77 |
-0.2 |
0 |
|
|
291620 |
113450249 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-154.66 |
3.9 |
-9.34 |
0.98 |
0 |
|
|
291621 |
113450429 |
1 |
BrON4C11H15 |
ABC4D11E15 |
21.4 |
3.54 |
-8.75 |
-0.93 |
0 |
|
|
291622 |
113450626 |
1 |
N2O5C11H20 |
A2B5C11D20 |
-241.86 |
5.95 |
-10.01 |
0.08 |
0 |
|
|
291623 |
113450854 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-81.49 |
4.2 |
-8.49 |
0.04 |
0 |
|
|
291624 |
113451031 |
1 |
O2N4C11H20 |
A2B4C11D20 |
-58.34 |
3.23 |
-8.57 |
0.06 |
0 |
|
|
291625 |
113452446 |
1 |
NOF3H10C13 |
ABC3D10E13 |
-138.05 |
2.06 |
-8.54 |
-0.29 |
0 |
|
|
291626 |
113452637 |
1 |
ClN2O4C12H13 |
AB2C4D12E13 |
-58.66 |
5.64 |
-9.97 |
-1.58 |
0 |
|
|
291627 |
113452863 |
1 |
FN3C13H22 |
AB3C13D22 |
-33.01 |
4.31 |
-9.0 |
-0.44 |
0 |
|
|
291628 |
113452931 |
1 |
FO2N4C11H15 |
AB2C4D11E15 |
-71.7 |
3.17 |
-9.35 |
-1.03 |
0 |
|
|
291629 |
113453433 |
2 |
NO2C6H6 |
AB2C6D6 |
-124.76 |
5.14 |
-9.79 |
-1.4 |
0 |
|
|
291630 |
113454352 |
1 |
BrSN2C13H13 |
ABC2D13E13 |
47.26 |
2.49 |
-8.55 |
-0.64 |
0 |
|
|
291631 |
113454376 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-99.5 |
3.86 |
-9.44 |
-0.88 |
0 |
|
|
291632 |
113454394 |
1 |
N2O3C12H14 |
A2B3C12D14 |
-91.43 |
3.03 |
-9.32 |
-1.13 |
0 |
|
|
291633 |
113454397 |
1 |
BrN2O3C11H11 |
AB2C3D11E11 |
-61.79 |
7.64 |
-9.46 |
-0.98 |
0 |
|
|
291634 |
113454448 |
1 |
BrNOH14C15 |
ABCD14E15 |
5.39 |
1.12 |
-9.03 |
-0.74 |
0 |
|
|
291635 |
113454451 |
1 |
BrNOC16H16 |
ABCD16E16 |
-3.13 |
1.13 |
-8.87 |
-0.78 |
0 |
|
|
291636 |
113454538 |
1 |
BrNO2H14C15 |
ABC2D14E15 |
-24.88 |
7.35 |
-9.45 |
-0.61 |
0 |
|
|
291637 |
113454637 |
1 |
BrClFNOH10C13 |
ABCDEF10G13 |
-48.47 |
3.24 |
-9.93 |
-0.75 |
0 |
|
|
291638 |
113454652 |
1 |
BrNOH14C15 |
ABCD14E15 |
29.33 |
4.02 |
-9.46 |
-0.52 |
0 |
|
|
291639 |
113454670 |
1 |
BrON2C13H21 |
ABC2D13E21 |
-29.5 |
5.76 |
-9.18 |
-0.38 |
0 |
|
|
291640 |
113454691 |
1 |
BrN2O3C12H15 |
AB2C3D12E15 |
-90.73 |
3.76 |
-10.08 |
-0.93 |
0 |
|
|
291641 |
113454721 |
1 |
O3C14H16 |
A3B14C16 |
-83.73 |
3.05 |
-8.91 |
0.05 |
0 |
|
|
291642 |
113454823 |
1 |
BrN3C13H14 |
AB3C13D14 |
66.88 |
2.75 |
-9.34 |
-0.38 |
0 |
|
|
291643 |
113454854 |
1 |
BrNOC15H16 |
ABCD15E16 |
-10.29 |
4.4 |
-9.36 |
-0.26 |
0 |
|
|
291644 |
113455199 |
1 |
NOC15H21 |
ABC15D21 |
0.2 |
0.52 |
-8.55 |
0.42 |
0 |
|
|
291645 |
113455628 |
1 |
ClFSO4H10C12 |
ABCD4E10F12 |
-161.48 |
2.91 |
-10.48 |
-1.83 |
0 |
|
|
291646 |
113455706 |
1 |
BrNO2C14H14 |
ABC2D14E14 |
-19.93 |
3.37 |
-8.91 |
-0.51 |
0 |
|
|
291647 |
113455739 |
1 |
BrNOC16H18 |
ABCD16E18 |
-3.57 |
2.6 |
-9.16 |
-0.73 |
0 |
|
|
291648 |
113455769 |
1 |
BrClNC15H21 |
ABCD15E21 |
-21.77 |
3.97 |
-9.86 |
-0.56 |
0 |
|
|
291649 |
113455844 |
1 |
BrN2C15H17 |
AB2C15D17 |
52.8 |
3.71 |
-9.29 |
-0.28 |
0 |