List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
422949 |
135118668 |
1 |
ON6C19H20 |
AB6C19D20 |
52.48 |
1.49 |
-9.04 |
-1.05 |
0 |
|
|
422950 |
135118669 |
1 |
O3N4C16H22 |
A3B4C16D22 |
-83.8 |
3.87 |
-9.02 |
-0.09 |
0 |
|
|
422951 |
135118670 |
2 |
ON2C8H12 |
AB2C8D12 |
-58.54 |
3.51 |
-8.57 |
0.42 |
0 |
|
|
422952 |
135118672 |
1 |
O4N5C28H35 |
A4B5C28D35 |
-65.54 |
6.02 |
-8.59 |
-0.28 |
0 |
|
|
422953 |
135118673 |
1 |
SO5N10C37H50 |
AB5C10D37E50 |
-99.51 |
8.25 |
-8.52 |
-0.9 |
0 |
|
|
422954 |
135118674 |
1 |
ClN2O4C16H17 |
AB2C4D16E17 |
-113.44 |
4.73 |
-9.66 |
-1.43 |
0 |
|
|
422955 |
135118678 |
1 |
O7N8C40H50 |
A7B8C40D50 |
-213.41 |
3.53 |
-8.39 |
-0.43 |
0 |
|
|
422956 |
135118681 |
1 |
N2O3C20H32 |
A2B3C20D32 |
-165.31 |
7.75 |
-9.05 |
0.86 |
0 |
|
|
422957 |
135118683 |
3 |
NOC6H9 |
ABC6D9 |
-111.93 |
4.2 |
-8.91 |
0.09 |
0 |
|
|
422958 |
135118685 |
2 |
ON2C11H12 |
AB2C11D12 |
-26.05 |
1.38 |
-8.3 |
-0.66 |
0 |
|
|
422959 |
135118686 |
1 |
N3O3C23H29 |
A3B3C23D29 |
-58.45 |
5.29 |
-8.61 |
-0.69 |
0 |
|
|
422960 |
135118689 |
1 |
SO2N5C16H21 |
AB2C5D16E21 |
-4.17 |
5.11 |
-9.5 |
-0.76 |
0 |
|
|
422961 |
135118691 |
1 |
N2O3C22H36 |
A2B3C22D36 |
-120.96 |
3.43 |
-8.07 |
0.52 |
0 |
|
|
422962 |
135118692 |
1 |
O3N5C14H19 |
A3B5C14D19 |
-22.15 |
4.83 |
-9.6 |
-0.49 |
0 |
|
|
422963 |
135118695 |
1 |
SN3O3C17H23 |
AB3C3D17E23 |
-63.79 |
5.51 |
-9.4 |
-0.64 |
0 |
|
|
422964 |
135118696 |
1 |
FON2C15H15 |
ABC2D15E15 |
-25.89 |
4.05 |
-9.15 |
-0.01 |
0 |
|
|
422965 |
135118697 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-21.25 |
3.98 |
-8.53 |
-0.85 |
0 |
|
|
422966 |
135118698 |
1 |
N3O4C19H27 |
A3B4C19D27 |
-144.51 |
8.12 |
-8.75 |
-0.41 |
0 |
|
|
422967 |
135118699 |
1 |
NO4C20H29 |
AB4C20D29 |
-159.66 |
3.85 |
-8.37 |
0.21 |
0 |
|
|
422968 |
135118702 |
2 |
N3O4C19H25 |
A3B4C19D25 |
-276.77 |
11.86 |
-9.1 |
-1.02 |
0 |
|
|
422969 |
135118704 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-152.92 |
5.53 |
-9.08 |
-1.16 |
0 |
|
|
422970 |
135118706 |
1 |
F2O2N3C20H21 |
A2B2C3D20E21 |
-144.45 |
3.02 |
-9.51 |
-0.52 |
0 |
|
|
422971 |
135118707 |
2 |
NOC10H16 |
ABC10D16 |
-81.61 |
5.04 |
-8.58 |
0.41 |
0 |
|
|
422972 |
135118708 |
2 |
NOC9H12 |
ABC9D12 |
-67.41 |
4.59 |
-9.18 |
0.23 |
0 |
|
|
422973 |
135118710 |
1 |
SN3O3C18H19 |
AB3C3D18E19 |
-41.89 |
1.09 |
-9.32 |
-1.05 |
0 |
|
|
422974 |
135118711 |
1 |
ON4C20H26 |
AB4C20D26 |
14.94 |
8.04 |
-8.69 |
-0.13 |
0 |
|
|
422975 |
135118712 |
1 |
ClNSO3C18H20 |
ABCD3E18F20 |
-90.43 |
5.58 |
-9.51 |
-0.7 |
0 |
|
|
422976 |
135118713 |
1 |
N3O3C21H31 |
A3B3C21D31 |
-141.74 |
4.44 |
-9.75 |
-0.14 |
0 |
|
|
422977 |
135118717 |
1 |
ON3C26H31 |
AB3C26D31 |
12.16 |
2.94 |
-8.29 |
-0.71 |
0 |
|
|
422978 |
135118718 |
1 |
OSN4C13H24 |
ABC4D13E24 |
-30.37 |
2.87 |
-8.79 |
0.14 |
0 |
|
|
422979 |
135118719 |
1 |
N5O6C26H39 |
A5B6C26D39 |
-250.7 |
7.37 |
-9.42 |
-0.31 |
0 |
|
|
422980 |
135118721 |
1 |
O3N5C23H31 |
A3B5C23D31 |
-60.9 |
3.59 |
-9.35 |
-0.96 |
0 |
|
|
422982 |
135118723 |
1 |
OSN3C17H23 |
ABC3D17E23 |
14.47 |
4.6 |
-8.88 |
-0.26 |
0 |
|
|
422983 |
135118726 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-31.59 |
6.35 |
-8.89 |
-0.42 |
0 |
|
|
422984 |
135118728 |
1 |
ON7C14H17 |
AB7C14D17 |
49.59 |
6.19 |
-9.02 |
-0.46 |
0 |
|
|
422985 |
135118729 |
1 |
OSN2C16H18 |
ABC2D16E18 |
9.95 |
6.59 |
-8.53 |
-0.45 |
0 |
|
|
422986 |
135118733 |
2 |
NOC11H15 |
ABC11D15 |
-80.41 |
3.11 |
-9.21 |
-0.58 |
0 |
|
|
422987 |
135118734 |
1 |
N2O3C21H30 |
A2B3C21D30 |
-121.06 |
6.61 |
-8.57 |
0.1 |
0 |
|
|
422988 |
135118735 |
1 |
ClO5N6C30H35 |
AB5C6D30E35 |
-129.83 |
4.52 |
-9.34 |
-0.63 |
0 |
|
|
422989 |
135118736 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
34.16 |
3.77 |
-8.8 |
-0.74 |
0 |
|
|
422990 |
135118737 |
2 |
ON2C12H12 |
AB2C12D12 |
-1.7 |
8.01 |
-8.72 |
-1.01 |
0 |
|
|
422991 |
135118739 |
1 |
NO4C20H27 |
AB4C20D27 |
-163.91 |
3.07 |
-9.74 |
0.0 |
0 |
|
|
422992 |
135118740 |
1 |
SN3O4C17H21 |
AB3C4D17E21 |
-99.94 |
1.84 |
-8.42 |
-0.23 |
0 |
|
|
422993 |
135118741 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-30.07 |
4.44 |
-9.46 |
-0.53 |
0 |
|
|
422994 |
135118742 |
1 |
ClSN2O4C15H19 |
ABC2D4E15F19 |
-87.88 |
9.53 |
-9.16 |
-0.87 |
0 |
|
|
422996 |
135118744 |
3 |
NOC6H7 |
ABC6D7 |
-100.34 |
7.38 |
-9.0 |
-1.03 |
0 |
|
|
422997 |
135118745 |
1 |
SN3O3C14H23 |
AB3C3D14E23 |
-97.83 |
4.69 |
-8.97 |
0.38 |
0 |
|
|
422998 |
135118746 |
1 |
SN2O4C18H22 |
AB2C4D18E22 |
-134.07 |
3.67 |
-9.65 |
-1.03 |
0 |
|
|
422999 |
135118747 |
1 |
SO5N9C34H43 |
AB5C9D34E43 |
-101.33 |
4.0 |
-9.46 |
-0.76 |
0 |
|
|
423000 |
135118748 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-10.85 |
3.1 |
-8.45 |
-0.5 |
0 |