List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
331606 |
127249615 |
1 |
O3N4C25H32 |
A3B4C25D32 |
-97.64 |
4.3 |
-9.3 |
-0.72 |
0 |
|
|
331607 |
127249616 |
1 |
O2N6C25H32 |
A2B6C25D32 |
-32.07 |
4.8 |
-9.06 |
-0.6 |
0 |
|
|
331608 |
127249617 |
1 |
N6C19H26 |
A6B19C26 |
88.17 |
4.08 |
-9.09 |
-0.94 |
0 |
|
|
331609 |
127249618 |
1 |
ClN6C22H23 |
AB6C22D23 |
120.83 |
4.87 |
-9.18 |
-0.98 |
0 |
|
|
331610 |
127249619 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-28.62 |
2.57 |
-8.73 |
-0.96 |
0 |
|
|
331611 |
127249620 |
1 |
ON6C18H22 |
AB6C18D22 |
38.91 |
4.6 |
-8.99 |
-1.18 |
0 |
|
|
331612 |
127249621 |
1 |
O2N5C23H27 |
A2B5C23D27 |
8.16 |
2.13 |
-8.69 |
-0.93 |
0 |
|
|
331613 |
127249622 |
1 |
O2N6C25H30 |
A2B6C25D30 |
-2.73 |
6.71 |
-8.83 |
-0.85 |
0 |
|
|
331614 |
127249623 |
1 |
O3N5C24H29 |
A3B5C24D29 |
-32.53 |
3.39 |
-8.76 |
-1.01 |
0 |
|
|
331615 |
127249624 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-36.91 |
2.27 |
-8.72 |
-0.93 |
0 |
|
|
331616 |
127249699 |
1 |
SO2N5C15H19 |
AB2C5D15E19 |
-11.79 |
5.07 |
-8.86 |
-1.0 |
0 |
|
|
331617 |
127249700 |
1 |
O3N4C15H18 |
A3B4C15D18 |
-39.8 |
3.65 |
-8.95 |
-0.42 |
0 |
|
|
331618 |
127249701 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-19.5 |
4.21 |
-8.82 |
-0.85 |
0 |
|
|
331619 |
127249702 |
1 |
ON4C23H26 |
AB4C23D26 |
37.21 |
1.18 |
-8.43 |
-0.2 |
0 |
|
|
331620 |
127249703 |
1 |
ON5C21H23 |
AB5C21D23 |
56.23 |
2.78 |
-8.75 |
-0.78 |
0 |
|
|
331621 |
127249704 |
1 |
OSN5C21H25 |
ABC5D21E25 |
57.33 |
3.7 |
-8.82 |
-0.94 |
0 |
|
|
331622 |
127249705 |
1 |
ON5C22H27 |
AB5C22D27 |
50.8 |
3.39 |
-8.04 |
0.15 |
0 |
|
|
331623 |
127249706 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-36.88 |
6.0 |
-8.5 |
-0.2 |
0 |
|
|
331624 |
127249707 |
1 |
FO2N5C21H26 |
AB2C5D21E26 |
-70.62 |
4.61 |
-8.65 |
-0.53 |
0 |
|
|
331625 |
127249708 |
1 |
SO2N6C19H26 |
AB2C6D19E26 |
-10.92 |
3.49 |
-8.8 |
-0.93 |
0 |
|
|
331626 |
127249709 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-30.26 |
5.24 |
-8.38 |
-0.2 |
0 |
|
|
331627 |
127249710 |
1 |
FO2N5C20H26 |
AB2C5D20E26 |
-73.27 |
4.34 |
-8.67 |
-0.52 |
0 |
|
|
331628 |
127249711 |
1 |
O3N5C24H27 |
A3B5C24D27 |
-38.1 |
5.07 |
-8.4 |
-0.29 |
0 |
|
|
331629 |
127249712 |
1 |
FO3N5C23H24 |
AB3C5D23E24 |
-74.66 |
4.06 |
-8.32 |
-0.72 |
0 |
|
|
331630 |
127249713 |
1 |
O3N6C22H24 |
A3B6C22D24 |
-17.89 |
2.65 |
-8.22 |
-0.7 |
0 |
|
|
331631 |
127249714 |
1 |
SO3N6C21H24 |
AB3C6D21E24 |
-12.42 |
3.11 |
-8.36 |
-1.04 |
0 |
|
|
331632 |
127249715 |
1 |
FO2N5C23H30 |
AB2C5D23E30 |
-79.69 |
3.76 |
-8.76 |
-0.69 |
0 |
|
|
331633 |
127249716 |
1 |
SO2N6C21H30 |
AB2C6D21E30 |
-20.84 |
5.22 |
-8.72 |
-0.88 |
0 |
|
|
331634 |
127249717 |
1 |
O2N5C23H31 |
A2B5C23D31 |
-43.34 |
4.75 |
-8.4 |
-0.14 |
0 |
|
|
331635 |
127249718 |
1 |
SO2N6C20H28 |
AB2C6D20E28 |
-18.28 |
5.98 |
-8.8 |
-0.93 |
0 |
|
|
331636 |
127249719 |
1 |
FO3N5C21H26 |
AB3C5D21E26 |
-104.85 |
2.56 |
-8.74 |
-0.61 |
0 |
|
|
331637 |
127249720 |
1 |
F2O2N5H21C22 |
A2B2C5D21E22 |
-82.17 |
1.79 |
-8.91 |
-0.79 |
0 |
|
|
331638 |
127249721 |
1 |
FSO2N6C20H21 |
ABC2D6E20F21 |
-19.69 |
2.0 |
-8.94 |
-1.0 |
0 |
|
|
331639 |
127249722 |
1 |
OSN5C18H27 |
ABC5D18E27 |
14.62 |
4.24 |
-8.75 |
-0.93 |
0 |
|
|
331640 |
127249723 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-33.08 |
4.96 |
-8.04 |
0.06 |
0 |
|
|
331641 |
127249724 |
1 |
SO3N5C20H21 |
AB3C5D20E21 |
-12.99 |
2.33 |
-8.92 |
-0.97 |
0 |
|
|
331642 |
127249725 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-12.61 |
4.55 |
-8.93 |
-1.02 |
0 |
|
|
331643 |
127249726 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-81.84 |
2.57 |
-8.65 |
-0.32 |
0 |
|
|
331644 |
127249727 |
1 |
SN4O4C22H24 |
AB4C4D22E24 |
-76.9 |
7.29 |
-8.66 |
-0.4 |
0 |
|
|
331645 |
127249728 |
1 |
O2N4C23H26 |
A2B4C23D26 |
5.47 |
2.02 |
-8.58 |
-0.38 |
0 |
|
|
331646 |
127249729 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-25.64 |
7.72 |
-8.31 |
0.05 |
0 |
|
|
331647 |
127249730 |
2 |
ON3C10H11 |
AB3C10D11 |
29.58 |
6.28 |
-8.13 |
-0.58 |
0 |
|
|
331648 |
127249731 |
1 |
SO3N5C16H21 |
AB3C5D16E21 |
-48.11 |
3.55 |
-8.82 |
-0.88 |
0 |
|
|
331649 |
127249732 |
1 |
FON4C18H21 |
ABC4D18E21 |
-3.61 |
1.64 |
-8.73 |
-0.59 |
0 |
|
|
331650 |
127249733 |
1 |
O3N4C24H26 |
A3B4C24D26 |
-47.17 |
1.82 |
-8.6 |
-0.36 |
0 |
|
|
331651 |
127249734 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-25.59 |
1.36 |
-8.93 |
-0.97 |
0 |
|
|
331652 |
127249735 |
1 |
SO3N5C22H25 |
AB3C5D22E25 |
-26.49 |
3.48 |
-8.88 |
-1.04 |
0 |
|
|
331653 |
127249736 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-14.19 |
6.27 |
-8.96 |
-1.06 |
0 |
|
|
331654 |
127249737 |
1 |
OSN5C21H25 |
ABC5D21E25 |
54.77 |
3.85 |
-8.82 |
-0.9 |
0 |
|
|
331655 |
127249738 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-75.16 |
2.97 |
-8.45 |
-0.24 |
0 |
|
|
331656 |
127249739 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-51.44 |
3.24 |
-9.02 |
-0.82 |
0 |
|
|
331657 |
127249740 |
1 |
FO2N5H20C21 |
AB2C5D20E21 |
-29.57 |
1.3 |
-8.89 |
-0.69 |
0 |
|
|
331658 |
127249741 |
1 |
ON6C19H20 |
AB6C19D20 |
62.08 |
2.7 |
-8.59 |
-0.31 |
0 |
|
|
331659 |
127249742 |
1 |
FON6H17C18 |
ABC6D17E18 |
30.94 |
0.6 |
-8.77 |
-0.6 |
0 |
|
|
331660 |
127249743 |
1 |
ON6C20H22 |
AB6C20D22 |
50.97 |
2.08 |
-8.6 |
-0.38 |
0 |
|
|
331661 |
127249744 |
1 |
ON6C21H24 |
AB6C21D24 |
38.97 |
3.2 |
-8.58 |
-0.26 |
0 |
|
|
331662 |
127249745 |
1 |
FON6C20H21 |
ABC6D20E21 |
6.83 |
2.49 |
-8.72 |
-0.62 |
0 |
|
|
331663 |
127249746 |
1 |
SO2N6H22C23 |
AB2C6D22E23 |
50.28 |
2.7 |
-9.08 |
-1.07 |
0 |
|
|
331664 |
127249747 |
1 |
O3N6C23H24 |
A3B6C23D24 |
26.53 |
2.04 |
-8.79 |
-0.44 |
0 |
|
|
331665 |
127249748 |
1 |
ON6C20H22 |
AB6C20D22 |
50.23 |
1.45 |
-8.76 |
-0.54 |
0 |
|
|
331666 |
127249749 |
1 |
ON6C21H24 |
AB6C21D24 |
36.29 |
2.92 |
-8.71 |
-0.4 |
0 |
|
|
331667 |
127249750 |
1 |
FON6C20H21 |
ABC6D20E21 |
5.8 |
1.32 |
-8.85 |
-0.75 |
0 |
|
|
331668 |
127249751 |
1 |
SO2N6C21H30 |
AB2C6D21E30 |
-23.43 |
3.42 |
-8.83 |
-0.86 |
0 |
|
|
331669 |
127249752 |
1 |
FO2N5C25H26 |
AB2C5D25E26 |
-35.69 |
2.45 |
-8.72 |
-0.77 |
0 |
|
|
331670 |
127249753 |
1 |
O2N6C25H30 |
A2B6C25D30 |
28.05 |
5.8 |
-8.33 |
-0.24 |
0 |
|
|
331671 |
127249754 |
1 |
O2N5H21C24 |
A2B5C21D24 |
42.9 |
5.15 |
-8.52 |
-1.11 |
0 |
|
|
331672 |
127249755 |
1 |
O2S2N6C19H22 |
A2B2C6D19E22 |
15.56 |
5.04 |
-8.85 |
-0.98 |
0 |
|
|
331673 |
127249756 |
1 |
FO2N6C21H23 |
AB2C6D21E23 |
-28.33 |
2.06 |
-8.81 |
-0.64 |
0 |
|
|
331674 |
127249757 |
1 |
SO2N6H22C23 |
AB2C6D22E23 |
50.97 |
4.97 |
-8.95 |
-1.02 |
0 |
|
|
331675 |
127249758 |
1 |
SO3N6H14C15 |
AB3C6D14E15 |
47.51 |
6.1 |
-9.21 |
-1.25 |
0 |
|
|
331676 |
127249759 |
1 |
OSN6C23H28 |
ABC6D23E28 |
59.79 |
4.75 |
-8.3 |
-0.95 |
0 |
|
|
331677 |
127249760 |
1 |
OSN6C22H22 |
ABC6D22E22 |
92.98 |
2.02 |
-8.9 |
-1.03 |
0 |
|
|
331678 |
127249761 |
1 |
OSN6C23H24 |
ABC6D23E24 |
83.87 |
9.16 |
-8.77 |
-0.92 |
0 |
|
|
331679 |
127249762 |
1 |
ON6C24H26 |
AB6C24D26 |
83.97 |
1.44 |
-8.16 |
-0.52 |
0 |
|
|
331680 |
127249763 |
2 |
ON3C10H11 |
AB3C10D11 |
18.39 |
3.75 |
-8.69 |
-0.49 |
0 |