List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
359588 |
127298862 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-94.43 |
2.95 |
-8.94 |
-0.8 |
0 |
|
|
359589 |
127298863 |
1 |
ClON5C18H22 |
ABC5D18E22 |
28.56 |
5.25 |
-8.75 |
-1.08 |
0 |
|
|
359590 |
127298864 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-13.79 |
5.24 |
-8.65 |
-0.76 |
0 |
|
|
359591 |
127298865 |
1 |
ON5C23H25 |
AB5C23D25 |
47.48 |
4.98 |
-8.8 |
-1.32 |
0 |
|
|
359592 |
127298866 |
1 |
O4N5C17H19 |
A4B5C17D19 |
-84.01 |
4.18 |
-8.97 |
-0.84 |
0 |
|
|
359593 |
127298867 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-102.44 |
5.11 |
-9.1 |
-0.75 |
0 |
|
|
359594 |
127298868 |
1 |
O3N6C20H22 |
A3B6C20D22 |
-11.67 |
5.55 |
-9.1 |
-0.69 |
0 |
|
|
359595 |
127298869 |
1 |
SO3N4C17H20 |
AB3C4D17E20 |
-49.45 |
6.52 |
-8.59 |
-0.91 |
0 |
|
|
359596 |
127298870 |
2 |
FON2C9H10 |
ABC2D9E10 |
-73.02 |
3.39 |
-9.51 |
-0.55 |
0 |
|
|
359597 |
127298871 |
1 |
O4N5C17H19 |
A4B5C17D19 |
-80.23 |
8.37 |
-9.12 |
-1.02 |
0 |
|
|
359598 |
127298872 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-103.73 |
4.8 |
-9.11 |
-0.76 |
0 |
|
|
359599 |
127298873 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-86.76 |
3.98 |
-9.01 |
-0.68 |
0 |
|
|
359600 |
127298874 |
1 |
O3N6C20H22 |
A3B6C20D22 |
-11.76 |
4.63 |
-8.8 |
-0.75 |
0 |
|
|
359601 |
127298875 |
1 |
SO4N5C15H17 |
AB4C5D15E17 |
-63.66 |
8.39 |
-9.45 |
-1.64 |
0 |
|
|
359602 |
127298876 |
1 |
SO4N5C14H15 |
AB4C5D14E15 |
-60.49 |
8.33 |
-9.75 |
-1.52 |
0 |
|
|
359603 |
127298877 |
1 |
SO4N5C13H13 |
AB4C5D13E13 |
-47.38 |
8.63 |
-9.6 |
-1.65 |
0 |
|
|
359604 |
127298878 |
1 |
SO3N6C17H22 |
AB3C6D17E22 |
-29.2 |
7.43 |
-8.8 |
-1.61 |
0 |
|
|
359605 |
127298879 |
1 |
SO4N5C15H17 |
AB4C5D15E17 |
-66.37 |
5.03 |
-9.79 |
-1.58 |
0 |
|
|
359606 |
127298880 |
1 |
SO3N6C17H22 |
AB3C6D17E22 |
-25.49 |
5.83 |
-8.81 |
-1.56 |
0 |
|
|
359607 |
127298881 |
1 |
SO3N6C16H18 |
AB3C6D16E18 |
7.59 |
7.41 |
-9.07 |
-1.65 |
0 |
|
|
359608 |
127298882 |
1 |
O3N4C22H22 |
A3B4C22D22 |
-26.83 |
5.4 |
-8.98 |
-0.89 |
0 |
|
|
359609 |
127298883 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-101.41 |
9.61 |
-9.18 |
-0.89 |
0 |
|
|
359610 |
127298884 |
1 |
O3N4C22H22 |
A3B4C22D22 |
-17.22 |
5.61 |
-9.04 |
-0.76 |
0 |
|
|
359611 |
127298885 |
1 |
ClFNO2C14H15 |
ABCD2E14F15 |
-123.19 |
3.62 |
-9.14 |
-0.44 |
0 |
|
|
359612 |
127298886 |
1 |
ClFNO2C15H17 |
ABCD2E15F17 |
-130.7 |
4.77 |
-9.07 |
-0.38 |
0 |
|
|
359613 |
127298887 |
1 |
ClFNO3C14H15 |
ABCD3E14F15 |
-155.81 |
4.53 |
-9.04 |
-0.37 |
0 |
|
|
359614 |
127298888 |
1 |
SF2N3O4H13C15 |
AB2C3D4E13F15 |
-216.48 |
4.05 |
-9.45 |
-1.44 |
0 |
|
|
359615 |
127298889 |
1 |
F2N2S2O5H10C13 |
A2B2C2D5E10F13 |
-257.61 |
6.18 |
-9.56 |
-1.67 |
0 |
|
|
359616 |
127298890 |
1 |
SF2N2O5H10C13 |
AB2C2D5E10F13 |
-242.89 |
7.05 |
-9.25 |
-1.3 |
0 |
|
|
359617 |
127298891 |
1 |
SF2N3O4H11C14 |
AB2C3D4E11F14 |
-212.76 |
7.54 |
-9.39 |
-1.41 |
0 |
|
|
359618 |
127298892 |
1 |
O2S2N5C17H21 |
A2B2C5D17E21 |
-22.32 |
8.84 |
-8.65 |
-0.76 |
0 |
|
|
359619 |
127298893 |
1 |
O2S3N4C16H18 |
A2B3C4D16E18 |
-4.37 |
3.82 |
-8.95 |
-1.05 |
0 |
|
|
359620 |
127298894 |
2 |
OSN2C8H9 |
ABC2D8E9 |
-19.75 |
3.63 |
-9.21 |
-1.29 |
0 |
|
|
359621 |
127298895 |
1 |
ClFNSO2C10H11 |
ABCDE2F10G11 |
-122.9 |
4.28 |
-8.87 |
-0.31 |
0 |
|
|
359622 |
127298896 |
1 |
O3N4C15H24 |
A3B4C15D24 |
-145.14 |
6.64 |
-8.86 |
0.06 |
0 |
|
|
359623 |
127298897 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-45.76 |
5.24 |
-8.68 |
-0.76 |
0 |
|
|
359624 |
127298898 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-172.12 |
5.08 |
-8.45 |
-0.07 |
0 |
|
|
359625 |
127298899 |
1 |
N3O5C19H23 |
A3B5C19D23 |
-186.68 |
5.86 |
-9.01 |
-0.12 |
0 |
|
|
359626 |
127298900 |
4 |
NOC5H6 |
ABC5D6 |
-152.31 |
3.97 |
-9.48 |
-0.37 |
0 |
|
|
359627 |
127298901 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-118.71 |
3.75 |
-8.16 |
-0.07 |
0 |
|
|
359628 |
127298902 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-123.31 |
6.23 |
-8.92 |
0.06 |
0 |
|
|
359629 |
127298903 |
1 |
SN4O4C18H22 |
AB4C4D18E22 |
-145.84 |
7.69 |
-9.46 |
-0.9 |
0 |
|
|
359630 |
127298904 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-156.05 |
7.25 |
-8.84 |
0.09 |
0 |
|
|
359631 |
127298905 |
1 |
SO3N5C17H23 |
AB3C5D17E23 |
-108.68 |
4.8 |
-9.06 |
-0.64 |
0 |
|
|
359632 |
127298906 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-77.15 |
4.57 |
-9.36 |
-0.31 |
0 |
|
|
359633 |
127298907 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-179.78 |
6.0 |
-9.86 |
0.0 |
0 |
|
|
359634 |
127298908 |
1 |
ClSN3O3C18H20 |
ABC3D3E18F20 |
-132.18 |
2.98 |
-8.76 |
-0.64 |
0 |
|
|
359635 |
127298909 |
1 |
FSN3O3C18H20 |
ABC3D3E18F20 |
-169.77 |
3.96 |
-8.68 |
-0.57 |
0 |
|
|
359636 |
127298910 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-98.53 |
5.54 |
-8.92 |
-0.16 |
0 |
|
|
359637 |
127298911 |
1 |
ClN3O5C17H18 |
AB3C5D17E18 |
-197.32 |
4.26 |
-8.63 |
-0.44 |
0 |