List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
332531 |
127250817 |
1 |
O2F3N5C21H24 |
A2B3C5D21E24 |
-141.15 |
3.22 |
-8.89 |
-0.54 |
0 |
|
|
332532 |
127250818 |
1 |
O2N5C22H29 |
A2B5C22D29 |
7.12 |
2.73 |
-8.6 |
0.16 |
0 |
|
|
332533 |
127250819 |
1 |
ClO2N5C22H28 |
AB2C5D22E28 |
-0.45 |
3.34 |
-8.63 |
-0.16 |
0 |
|
|
332534 |
127250820 |
1 |
O2N5C25H35 |
A2B5C25D35 |
-10.07 |
3.65 |
-8.54 |
0.21 |
0 |
|
|
332535 |
127250821 |
1 |
ClO3N5C20H22 |
AB3C5D20E22 |
-21.9 |
1.78 |
-9.11 |
-0.26 |
0 |
|
|
332536 |
127250822 |
1 |
ClO3N5C20H22 |
AB3C5D20E22 |
-25.01 |
3.11 |
-9.32 |
-0.28 |
0 |
|
|
332537 |
127250823 |
1 |
FO2N5C20H24 |
AB2C5D20E24 |
-22.07 |
2.24 |
-9.0 |
-0.2 |
0 |
|
|
332538 |
127250824 |
1 |
ClO2N5C20H24 |
AB2C5D20E24 |
14.76 |
3.43 |
-8.99 |
-0.32 |
0 |
|
|
332539 |
127250825 |
1 |
ClO2N5C20H24 |
AB2C5D20E24 |
14.16 |
2.07 |
-9.0 |
-0.26 |
0 |
|
|
332540 |
127250826 |
1 |
ClO2N5C20H24 |
AB2C5D20E24 |
11.98 |
3.63 |
-8.99 |
-0.26 |
0 |
|
|
332541 |
127250827 |
1 |
ClO2N5C22H28 |
AB2C5D22E28 |
-1.12 |
1.81 |
-8.57 |
-0.28 |
0 |
|
|
332542 |
127250828 |
1 |
ClO2N5C22H28 |
AB2C5D22E28 |
2.11 |
4.04 |
-8.54 |
-0.28 |
0 |
|
|
332543 |
127250829 |
1 |
ClO2N5C22H28 |
AB2C5D22E28 |
-2.94 |
1.23 |
-8.64 |
-0.21 |
0 |
|
|
332544 |
127250830 |
1 |
FSO3N5C21H24 |
ABC3D5E21F24 |
-81.14 |
3.93 |
-8.77 |
-0.54 |
0 |
|
|
332545 |
127250831 |
1 |
ClSO3N4C21H23 |
ABC3D4E21F23 |
-47.1 |
4.95 |
-9.14 |
-0.48 |
0 |
|
|
332546 |
127250832 |
1 |
ClSO3N4C21H23 |
ABC3D4E21F23 |
-51.45 |
4.6 |
-9.28 |
-0.45 |
0 |
|
|
332547 |
127250833 |
1 |
ClO4N5C21H22 |
AB4C5D21E22 |
-60.04 |
2.35 |
-9.11 |
-1.05 |
0 |
|
|
332548 |
127250834 |
1 |
FN3O3C20H26 |
AB3C3D20E26 |
-112.18 |
1.75 |
-8.67 |
-0.17 |
0 |
|
|
332549 |
127250835 |
1 |
F3O3N4C20H25 |
A3B3C4D20E25 |
-224.27 |
3.61 |
-9.24 |
-0.47 |
0 |
|
|
332550 |
127250836 |
1 |
ClO3N6C21H25 |
AB3C6D21E25 |
-34.43 |
3.05 |
-9.1 |
-0.32 |
0 |
|
|
332551 |
127250837 |
1 |
ClO3N6C21H25 |
AB3C6D21E25 |
-32.52 |
2.39 |
-9.12 |
-0.28 |
0 |
|
|
332552 |
127250838 |
1 |
ClO3N6C21H25 |
AB3C6D21E25 |
-35.07 |
3.74 |
-9.32 |
-0.28 |
0 |
|
|
332553 |
127250839 |
1 |
FO3N5C22H24 |
AB3C5D22E24 |
-72.84 |
4.85 |
-8.81 |
-0.24 |
0 |
|
|
332554 |
127250840 |
1 |
ClO3N5C22H24 |
AB3C5D22E24 |
-34.24 |
4.11 |
-8.82 |
-0.35 |
0 |
|
|
332555 |
127250841 |
1 |
ClO3N5C22H24 |
AB3C5D22E24 |
-32.17 |
5.22 |
-8.82 |
-0.32 |
0 |
|
|
332556 |
127250842 |
1 |
ClO3N5C22H24 |
AB3C5D22E24 |
-33.66 |
5.67 |
-8.79 |
-0.42 |
0 |
|
|
332557 |
127250843 |
1 |
F2O3N5C22H23 |
A2B3C5D22E23 |
-114.71 |
4.37 |
-8.98 |
-0.58 |
0 |
|
|
332558 |
127250844 |
1 |
ClN4O4C22H23 |
AB4C4D22E23 |
-86.54 |
1.16 |
-9.09 |
-0.7 |
0 |
|
|
332559 |
127250845 |
1 |
O4N5C23H27 |
A4B5C23D27 |
-75.96 |
3.7 |
-8.94 |
-0.82 |
0 |
|
|
332560 |
127250846 |
1 |
ClO3N5C22H24 |
AB3C5D22E24 |
-42.54 |
2.8 |
-9.08 |
-0.85 |
0 |
|
|
332561 |
127250847 |
1 |
ClO3N5C22H24 |
AB3C5D22E24 |
-40.96 |
3.35 |
-9.09 |
-0.83 |
0 |
|
|
332562 |
127250848 |
1 |
F2O3N5C22H23 |
A2B3C5D22E23 |
-123.52 |
4.19 |
-9.45 |
-0.85 |
0 |
|
|
332563 |
127250849 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-24.74 |
2.69 |
-8.65 |
0.21 |
0 |
|
|
332564 |
127250850 |
1 |
ClO2N5C21H26 |
AB2C5D21E26 |
6.28 |
2.34 |
-8.69 |
-0.24 |
0 |
|
|
332565 |
127250851 |
1 |
O2N5C24H33 |
A2B5C24D33 |
-2.97 |
2.37 |
-8.64 |
0.19 |
0 |
|
|
332566 |
127250852 |
1 |
O2F3N5C22H26 |
A2B3C5D22E26 |
-148.07 |
2.19 |
-8.69 |
-0.57 |
0 |
|
|
332567 |
127250853 |
1 |
ClN4O4C21H23 |
AB4C4D21E23 |
-50.08 |
0.29 |
-9.1 |
-0.68 |
0 |
|
|
332568 |
127250854 |
1 |
FSO3N5C21H24 |
ABC3D5E21F24 |
-79.78 |
6.11 |
-9.02 |
-0.43 |
0 |
|
|
332569 |
127250855 |
1 |
ClO3N5C21H24 |
AB3C5D21E24 |
-30.04 |
5.36 |
-9.12 |
-0.2 |
0 |
|
|
332570 |
127250856 |
1 |
FO2N5C19H22 |
AB2C5D19E22 |
-33.81 |
4.2 |
-8.84 |
0.12 |
0 |
|
|
332571 |
127250857 |
1 |
FO2N5C19H22 |
AB2C5D19E22 |
-39.39 |
1.56 |
-9.03 |
0.15 |
0 |
|
|
332572 |
127250858 |
1 |
ClO2N5C19H22 |
AB2C5D19E22 |
3.24 |
2.06 |
-9.02 |
-0.31 |
0 |
|
|
332573 |
127250859 |
1 |
ClO2N5C19H22 |
AB2C5D19E22 |
6.77 |
1.99 |
-8.96 |
-0.2 |
0 |
|
|
332574 |
127250860 |
1 |
F2O2N5C19H21 |
A2B2C5D19E21 |
-78.55 |
2.87 |
-9.04 |
-0.55 |
0 |
|
|
332575 |
127250861 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-2.57 |
5.15 |
-8.84 |
0.11 |
0 |
|
|
332576 |
127250862 |
1 |
O2F3N5C20H22 |
A2B3C5D20E22 |
-149.78 |
4.18 |
-9.04 |
-0.76 |
0 |
|
|
332577 |
127250863 |
1 |
ClSO3N5C20H22 |
ABC3D5E20F22 |
-21.18 |
4.01 |
-9.17 |
-1.26 |
0 |
|
|
332578 |
127250864 |
1 |
ClO3N5C21H22 |
AB3C5D21E22 |
-36.94 |
4.41 |
-8.99 |
-0.43 |
0 |
|
|
332579 |
127250865 |
1 |
F2O3N5C20H21 |
A2B3C5D20E21 |
-104.94 |
2.53 |
-9.4 |
-0.56 |
0 |
|
|
332580 |
127250866 |
1 |
FO3N6H21C22 |
AB3C6D21E22 |
-23.43 |
6.4 |
-9.13 |
-1.4 |
0 |
|
|
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 |