List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
332581 |
127250867 |
1 |
FN4O4C23H29 |
AB4C4D23E29 |
-164.65 |
4.12 |
-9.11 |
-0.13 |
0 |
|
|
332582 |
127250868 |
1 |
ClN4O4C22H25 |
AB4C4D22E25 |
-70.53 |
4.93 |
-9.21 |
-0.43 |
0 |
|
|
332583 |
127250869 |
1 |
ClN4O4C22H25 |
AB4C4D22E25 |
-69.25 |
5.49 |
-9.16 |
-0.34 |
0 |
|
|
332584 |
127250870 |
1 |
ClN4O4C22H25 |
AB4C4D22E25 |
-70.94 |
5.19 |
-9.41 |
-0.43 |
0 |
|
|
332585 |
127250871 |
1 |
N3O3C24H29 |
A3B3C24D29 |
-45.03 |
2.67 |
-8.45 |
0.21 |
0 |
|
|
332586 |
127250872 |
1 |
FN3O3C24H28 |
AB3C3D24E28 |
-88.99 |
3.39 |
-8.45 |
-0.09 |
0 |
|
|
332587 |
127250873 |
1 |
FO2N4C25H27 |
AB2C4D25E27 |
-24.93 |
4.4 |
-8.4 |
-0.23 |
0 |
|
|
332588 |
127250874 |
1 |
O3N4C26H30 |
A3B4C26D30 |
-15.09 |
3.96 |
-8.2 |
0.02 |
0 |
|
|
332589 |
127250875 |
1 |
ClO2N5C23H30 |
AB2C5D23E30 |
-10.41 |
3.87 |
-8.65 |
-0.21 |
0 |
|
|
332590 |
127250876 |
1 |
ClO2N5C23H30 |
AB2C5D23E30 |
-6.82 |
2.23 |
-8.62 |
-0.24 |
0 |
|
|
332591 |
127250877 |
2 |
ON3C12H14 |
AB3C12D14 |
43.19 |
3.26 |
-8.78 |
-0.52 |
0 |
|
|
332592 |
127250878 |
1 |
FN3O3C25H28 |
AB3C3D25E28 |
-103.4 |
3.69 |
-9.05 |
-0.34 |
0 |
|
|
332593 |
127250879 |
1 |
ClSO2N4C20H23 |
ABC2D4E20F23 |
0.25 |
2.04 |
-8.91 |
-0.35 |
0 |
|
|
332594 |
127250880 |
1 |
ClSO2N4C20H23 |
ABC2D4E20F23 |
2.15 |
3.7 |
-8.89 |
-0.3 |
0 |
|
|
332595 |
127250881 |
1 |
ClSO2N4C20H23 |
ABC2D4E20F23 |
-0.87 |
1.7 |
-8.9 |
-0.34 |
0 |
|
|
332596 |
127250882 |
1 |
FO4N5C21H26 |
AB4C5D21E26 |
-143.51 |
3.39 |
-9.41 |
-0.24 |
0 |
|
|
332597 |
127250883 |
1 |
F2O4N5C21H25 |
A2B4C5D21E25 |
-185.72 |
2.35 |
-9.45 |
-0.61 |
0 |
|
|
332598 |
127250884 |
1 |
FO4N5C21H24 |
AB4C5D21E24 |
-98.2 |
4.26 |
-9.39 |
-0.33 |
0 |
|
|
332599 |
127250885 |
1 |
ClO4N5C21H24 |
AB4C5D21E24 |
-60.41 |
3.91 |
-9.09 |
-0.32 |
0 |
|
|
332600 |
127250886 |
1 |
ClO4N5C21H24 |
AB4C5D21E24 |
-58.41 |
2.79 |
-9.13 |
-0.32 |
0 |
|
|
332601 |
127250887 |
1 |
ClO4N5C21H24 |
AB4C5D21E24 |
-61.43 |
7.68 |
-9.42 |
-0.38 |
0 |
|
|
332602 |
127250888 |
1 |
FO3N5C24H24 |
AB3C5D24E24 |
-48.87 |
4.32 |
-8.99 |
-0.54 |
0 |
|
|
332603 |
127250889 |
1 |
FO3N5C24H24 |
AB3C5D24E24 |
-46.68 |
6.57 |
-8.99 |
-0.56 |
0 |
|
|
332604 |
127250890 |
1 |
FO3N5C24H24 |
AB3C5D24E24 |
-54.5 |
3.76 |
-8.94 |
-0.52 |
0 |
|
|
332605 |
127250891 |
1 |
ON6C26H30 |
AB6C26D30 |
25.88 |
6.13 |
-8.82 |
-0.55 |
0 |
|
|
332606 |
127250892 |
1 |
ON6C26H32 |
AB6C26D32 |
19.44 |
8.03 |
-8.93 |
-0.25 |
0 |
|
|
332607 |
127250893 |
1 |
ON6C26H30 |
AB6C26D30 |
46.91 |
6.98 |
-8.7 |
-0.01 |
0 |
|
|
332608 |
127250894 |
1 |
O2N5C25H29 |
A2B5C25D29 |
-15.8 |
8.63 |
-8.88 |
-0.23 |
0 |
|
|
332609 |
127250895 |
1 |
OSN5C25H29 |
ABC5D25E29 |
21.59 |
8.52 |
-8.78 |
-0.36 |
0 |
|
|
332610 |
127250896 |
1 |
SO2N5C23H33 |
AB2C5D23E33 |
-48.06 |
6.92 |
-8.73 |
-0.02 |
0 |
|
|
332611 |
127250897 |
1 |
ON6C24H28 |
AB6C24D28 |
45.89 |
5.59 |
-8.78 |
-0.08 |
0 |
|
|
332612 |
127250898 |
1 |
O2N5C26H31 |
A2B5C26D31 |
-2.0 |
5.43 |
-8.77 |
-0.1 |
0 |
|
|
332613 |
127250899 |
1 |
O2N5C23H29 |
A2B5C23D29 |
-52.61 |
3.99 |
-8.7 |
0.01 |
0 |
|
|
332614 |
127250900 |
2 |
ON2C11H14 |
AB2C11D14 |
-42.49 |
4.46 |
-8.72 |
0.0 |
0 |
|
|
332615 |
127250901 |
1 |
O2N4C27H30 |
A2B4C27D30 |
-13.0 |
6.34 |
-8.8 |
-0.08 |
0 |
|
|
332616 |
127250902 |
1 |
SO2N5C21H29 |
AB2C5D21E29 |
-34.45 |
5.39 |
-8.71 |
0.01 |
0 |
|
|
332617 |
127250903 |
1 |
ON4C23H30 |
AB4C23D30 |
-16.3 |
7.56 |
-8.83 |
-0.1 |
0 |
|
|
332618 |
127250904 |
1 |
SO2N4C20H26 |
AB2C4D20E26 |
-43.41 |
6.39 |
-8.7 |
0.02 |
0 |
|
|
332619 |
127250905 |
1 |
SO2N4C21H28 |
AB2C4D21E28 |
-47.17 |
7.6 |
-8.74 |
-0.03 |
0 |
|
|
332620 |
127250906 |
1 |
ON4C25H32 |
AB4C25D32 |
-16.23 |
7.77 |
-8.84 |
-0.12 |
0 |
|
|
332621 |
127250907 |
1 |
O2N3C16H17 |
A2B3C16D17 |
-23.8 |
4.99 |
-9.26 |
-0.57 |
0 |
|
|
332622 |
127250908 |
1 |
O2N3C16H17 |
A2B3C16D17 |
-23.91 |
4.47 |
-9.24 |
-0.59 |
0 |
|
|
332623 |
127250909 |
1 |
FON2C16H17 |
ABC2D16E17 |
-35.59 |
2.33 |
-9.17 |
0.0 |
0 |
|
|
332624 |
127250910 |
1 |
ClON5C18H18 |
ABC5D18E18 |
75.81 |
4.26 |
-9.06 |
-1.08 |
0 |
|
|
332625 |
127250911 |
1 |
ON5C19H21 |
AB5C19D21 |
81.12 |
3.94 |
-8.89 |
-1.21 |
0 |
|
|
332626 |
127250912 |
3 |
ON2C7H8 |
AB2C7D8 |
-1.7 |
6.74 |
-8.39 |
-1.39 |
0 |
|
|
332627 |
127250913 |
1 |
FO2N6C20H21 |
AB2C6D20E21 |
-5.86 |
3.09 |
-8.81 |
-1.39 |
0 |
|
|
332628 |
127250914 |
1 |
O2N5C15H19 |
A2B5C15D19 |
3.41 |
4.61 |
-9.23 |
-1.43 |
0 |
|
|
332629 |
127250915 |
1 |
O4N5C21H23 |
A4B5C21D23 |
-38.55 |
2.92 |
-8.97 |
-1.26 |
0 |
|
|
332630 |
127250916 |
1 |
SO4N5C18H19 |
AB4C5D18E19 |
-32.69 |
6.63 |
-9.67 |
-1.05 |
0 |
|
|
332631 |
127250917 |
1 |
SO3N6C15H22 |
AB3C6D15E22 |
-28.84 |
2.81 |
-9.61 |
-1.22 |
0 |
|
|
332632 |
127250918 |
1 |
SO3N6C16H24 |
AB3C6D16E24 |
-31.27 |
0.66 |
-9.51 |
-1.28 |
0 |
|
|
332633 |
127250919 |
1 |
O3N5C22H25 |
A3B5C22D25 |
-8.09 |
3.67 |
-9.21 |
-1.35 |
0 |
|
|
332634 |
127250920 |
1 |
ClSO3N5H16C17 |
ABC3D5E16F17 |
5.24 |
3.44 |
-9.65 |
-1.26 |
0 |
|
|
332635 |
127250921 |
2 |
ON3H10C11 |
AB3C10D11 |
72.51 |
3.47 |
-9.31 |
-1.33 |
0 |
|
|
332636 |
127250922 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-42.96 |
9.12 |
-9.43 |
-1.53 |
0 |
|
|
332637 |
127250923 |
1 |
SO2N6C17H18 |
AB2C6D17E18 |
48.01 |
5.11 |
-9.47 |
-1.41 |
0 |
|
|
332638 |
127250924 |
1 |
O3N6H22C23 |
A3B6C22D23 |
14.34 |
10.4 |
-8.8 |
-1.09 |
0 |
|
|
332639 |
127250925 |
3 |
ON2C8H8 |
AB2C8D8 |
20.85 |
4.11 |
-9.09 |
-1.37 |
0 |
|
|
332640 |
127250926 |
1 |
O3N6C20H24 |
A3B6C20D24 |
10.84 |
7.03 |
-9.55 |
-1.42 |
0 |
|
|
332641 |
127250927 |
2 |
ON3C11H11 |
AB3C11D11 |
51.79 |
4.76 |
-8.46 |
-1.38 |
0 |
|
|
332642 |
127250928 |
1 |
O3N6C20H26 |
A3B6C20D26 |
-37.43 |
7.72 |
-9.17 |
-1.52 |
0 |
|
|
332643 |
127250929 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-19.64 |
3.56 |
-8.91 |
-1.32 |
0 |
|
|
332644 |
127250930 |
1 |
FSO3N5C19H20 |
ABC3D5E19F20 |
-54.1 |
4.73 |
-9.79 |
-1.21 |
0 |
|
|
332645 |
127250931 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-58.66 |
3.22 |
-9.62 |
-1.47 |
0 |
|
|
332646 |
127250932 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-62.23 |
7.46 |
-9.56 |
-1.45 |
0 |
|
|
332647 |
127250933 |
1 |
ClO2N5C20H20 |
AB2C5D20E20 |
24.05 |
2.51 |
-9.51 |
-1.44 |
0 |
|
|
332648 |
127250934 |
1 |
FO3N5C20H20 |
AB3C5D20E20 |
-49.01 |
4.99 |
-9.18 |
-1.54 |
0 |
|
|
332649 |
127250935 |
1 |
FO3N5C21H22 |
AB3C5D21E22 |
-53.38 |
6.02 |
-9.12 |
-1.5 |
0 |
|
|
332650 |
127250936 |
1 |
O3N5C21H23 |
A3B5C21D23 |
-4.73 |
6.04 |
-8.77 |
-1.4 |
0 |
|
|
332651 |
127250937 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-48.03 |
4.33 |
-9.88 |
-1.13 |
0 |
|
|
332652 |
127250938 |
1 |
O2N5C20H23 |
A2B5C20D23 |
34.48 |
5.64 |
-8.56 |
-0.95 |
0 |
|
|
332653 |
127250939 |
1 |
O2N5C22H25 |
A2B5C22D25 |
29.07 |
3.61 |
-8.46 |
-1.13 |
0 |
|
|
332654 |
127250940 |
1 |
FON6C21H21 |
ABC6D21E21 |
43.53 |
4.41 |
-8.54 |
-1.15 |
0 |
|
|
332655 |
127250941 |
1 |
O2N6C25H30 |
A2B6C25D30 |
45.93 |
4.28 |
-7.74 |
-1.05 |
0 |