List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
435590 |
135191873 |
1 |
ON2C16H22 |
AB2C16D22 |
-19.84 |
3.99 |
-9.11 |
0.18 |
0 |
|
|
435591 |
135191876 |
1 |
ClO3C24H31 |
AB3C24D31 |
-126.49 |
4.31 |
-8.78 |
0.04 |
0 |
|
|
435592 |
135191887 |
1 |
FN3C26H36 |
AB3C26D36 |
-18.72 |
5.26 |
-7.56 |
-0.18 |
0 |
|
|
435593 |
135191888 |
1 |
ON3C14H17 |
AB3C14D17 |
5.18 |
6.33 |
-9.39 |
-0.08 |
0 |
|
|
435594 |
135191889 |
1 |
N3O4C16H23 |
A3B4C16D23 |
-119.84 |
5.77 |
-8.53 |
-0.24 |
0 |
|
|
435595 |
135191890 |
1 |
ON3C11H13 |
AB3C11D13 |
6.14 |
2.99 |
-9.2 |
-0.11 |
0 |
|
|
435596 |
135191893 |
2 |
ON3C7H8 |
AB3C7D8 |
43.83 |
5.29 |
-8.92 |
-0.53 |
0 |
|
|
435597 |
135191894 |
1 |
NO2C14H21 |
AB2C14D21 |
-70.81 |
5.31 |
-8.99 |
0.24 |
0 |
|
|
435598 |
135191901 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-57.78 |
8.75 |
-9.24 |
-0.14 |
0 |
|
|
435599 |
135191903 |
1 |
O6C15H16 |
A6B15C16 |
-244.63 |
6.43 |
-10.27 |
-0.84 |
0 |
|
|
435600 |
135191907 |
1 |
ON3C13H17 |
AB3C13D17 |
18.18 |
5.48 |
-9.67 |
-0.11 |
0 |
|
|
435601 |
135191911 |
1 |
BrNOC11H14 |
ABCD11E14 |
-17.73 |
5.12 |
-8.5 |
0.02 |
0 |
|
|
435602 |
135191916 |
1 |
N4O5C17H20 |
A4B5C17D20 |
-125.34 |
4.0 |
-9.88 |
-1.36 |
0 |
|
|
435603 |
135191917 |
1 |
F2O3N5H19C20 |
A2B3C5D19E20 |
-135.62 |
1.1 |
-9.05 |
-0.52 |
0 |
|
|
435604 |
135191923 |
2 |
FON2C11H11 |
ABC2D11E11 |
-111.79 |
3.5 |
-8.87 |
-0.41 |
0 |
|
|
435605 |
135191926 |
1 |
O3N5C15H25 |
A3B5C15D25 |
-110.73 |
6.1 |
-8.82 |
-0.18 |
0 |
|
|
435606 |
135191936 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-42.07 |
6.34 |
-9.52 |
-0.34 |
0 |
|
|
435607 |
135191937 |
1 |
N3O4C22H25 |
A3B4C22D25 |
-103.45 |
3.98 |
-8.79 |
-0.36 |
0 |
|
|
435608 |
135191938 |
1 |
ClFO2N5C20H21 |
ABC2D5E20F21 |
-59.53 |
8.55 |
-9.47 |
-0.88 |
0 |
|
|
435609 |
135191939 |
1 |
N2O3H18C19 |
A2B3C18D19 |
-52.9 |
2.36 |
-8.96 |
-0.47 |
0 |
|
|
435610 |
135191940 |
1 |
NO3C14H21 |
AB3C14D21 |
-116.39 |
5.86 |
-9.62 |
0.56 |
0 |
|
|
435611 |
135191946 |
1 |
ON3C9H15 |
AB3C9D15 |
-1.42 |
4.59 |
-8.93 |
0.09 |
0 |
|
|
435612 |
135191949 |
2 |
O3C11H11 |
A3B11C11 |
-215.78 |
5.09 |
-9.66 |
-0.72 |
0 |
|
|
435613 |
135191950 |
1 |
O5C15H18 |
A5B15C18 |
-208.12 |
2.1 |
-9.69 |
0.0 |
0 |
|
|
435614 |
135191952 |
1 |
ON3C15H19 |
AB3C15D19 |
10.98 |
5.9 |
-9.1 |
-0.41 |
0 |
|
|
435615 |
135191953 |
1 |
O2N4C25H32 |
A2B4C25D32 |
-26.04 |
3.56 |
-9.02 |
-0.3 |
0 |
|
|
435616 |
135191954 |
1 |
SN3O6C16H21 |
AB3C6D16E21 |
-205.12 |
5.59 |
-9.2 |
-1.09 |
0 |
|
|
435617 |
135191955 |
1 |
O4N7H19C23 |
A4B7C19D23 |
47.76 |
9.32 |
-9.56 |
-1.25 |
0 |
|
|
435618 |
135191957 |
1 |
NO6C15H17 |
AB6C15D17 |
-169.79 |
6.95 |
-10.66 |
-1.75 |
0 |
|
|
435619 |
135191958 |
1 |
ClO3N5C20H20 |
AB3C5D20E20 |
-36.87 |
4.81 |
-8.98 |
-0.55 |
0 |
|
|
435620 |
135191959 |
1 |
ON2F3C12H15 |
AB2C3D12E15 |
-178.54 |
4.73 |
-8.77 |
-0.28 |
0 |
|
|
435621 |
135191960 |
1 |
NO4C12H15 |
AB4C12D15 |
-146.56 |
1.83 |
-9.54 |
-0.8 |
0 |
|
|
435622 |
135191961 |
1 |
N3O5C13H15 |
A3B5C13D15 |
-136.43 |
4.43 |
-8.32 |
-0.76 |
0 |
|
|
435623 |
135191963 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-35.85 |
3.62 |
-8.77 |
-0.47 |
0 |
|
|
435624 |
135191966 |
1 |
ClO2N4H21C22 |
AB2C4D21E22 |
-11.96 |
2.79 |
-9.24 |
-0.61 |
0 |
|
|
435625 |
135191967 |
4 |
NOC7H7 |
ABC7D7 |
-42.02 |
2.2 |
-8.6 |
-0.83 |
0 |
|
|
435626 |
135191968 |
4 |
NOH4C5 |
ABC4D5 |
-4.27 |
3.11 |
-9.17 |
-1.08 |
0 |
|
|
435627 |
135191969 |
1 |
ON2C10H14 |
AB2C10D14 |
-28.77 |
1.67 |
-8.71 |
0.25 |
0 |
|
|
435628 |
135191970 |
1 |
NO4C13H17 |
AB4C13D17 |
-148.39 |
2.71 |
-8.87 |
-0.78 |
0 |
|
|
435629 |
135191972 |
1 |
ClON2C11H15 |
ABC2D11E15 |
-43.33 |
2.69 |
-9.26 |
-0.57 |
1 |
|
|
435630 |
135191974 |
1 |
PO3N4C22H22 |
AB3C4D22E22 |
-4.13 |
6.94 |
0.0 |
0.0 |
0 |
|
|
435631 |
135191976 |
1 |
ON5C9H13 |
AB5C9D13 |
27.48 |
3.56 |
-9.09 |
-0.45 |
0 |
|
|
435632 |
135191987 |
1 |
O4N8C25H26 |
A4B8C25D26 |
40.65 |
2.78 |
-9.03 |
-0.74 |
0 |
|
|
435633 |
135192001 |
1 |
NF2O2C16H19 |
AB2C2D16E19 |
-154.58 |
5.72 |
-9.46 |
-0.35 |
0 |
|
|
435634 |
135192006 |
1 |
N3O6C24H25 |
A3B6C24D25 |
-141.33 |
3.08 |
-9.0 |
-0.91 |
0 |
|
|
435635 |
135192015 |
1 |
F2N2O5C15H16 |
A2B2C5D15E16 |
-274.04 |
5.31 |
-9.1 |
-1.18 |
0 |
|
|
435636 |
135192018 |
1 |
ON4C9H14 |
AB4C9D14 |
-16.72 |
4.34 |
-9.21 |
-0.49 |
0 |
|
|
435637 |
135192019 |
1 |
FON3C12H14 |
ABC3D12E14 |
-37.71 |
3.82 |
-9.46 |
-0.33 |
0 |
|
|
435638 |
135192020 |
1 |
O2N4C25H30 |
A2B4C25D30 |
-8.98 |
2.22 |
-9.01 |
-0.22 |
0 |
|
|
435639 |
135192022 |
1 |
N5C37H41 |
A5B37C41 |
146.71 |
8.18 |
-7.4 |
-0.39 |
0 |