List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364591 |
127315843 |
1 |
N2C13H28 |
A2B13C28 |
-33.01 |
2.53 |
-8.35 |
2.78 |
0 |
|
|
364592 |
127315844 |
2 |
NC7H14 |
AB7C14 |
-27.15 |
2.47 |
-8.36 |
2.79 |
0 |
|
|
364593 |
127315845 |
1 |
SN3C12H21 |
AB3C12D21 |
22.29 |
3.8 |
-8.54 |
-0.2 |
0 |
|
|
364594 |
127315846 |
2 |
N2C7H13 |
A2B7C13 |
19.29 |
3.82 |
-8.32 |
0.94 |
0 |
|
|
364595 |
127315847 |
1 |
ON3C13H23 |
AB3C13D23 |
-1.61 |
1.48 |
-8.55 |
0.2 |
0 |
|
|
364596 |
127315848 |
1 |
N3O4C18H19 |
A3B4C18D19 |
-139.75 |
5.49 |
-9.8 |
-1.48 |
0 |
|
|
364597 |
127315849 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-125.42 |
4.46 |
-9.32 |
-0.04 |
0 |
|
|
364598 |
127315850 |
1 |
O2N5C14H19 |
A2B5C14D19 |
-42.36 |
7.33 |
-9.71 |
-0.16 |
0 |
|
|
364599 |
127315851 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-173.83 |
1.39 |
-9.53 |
0.04 |
0 |
|
|
364600 |
127315852 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-138.91 |
1.92 |
-9.56 |
0.22 |
0 |
|
|
364601 |
127315853 |
1 |
NO2C15H19 |
AB2C15D19 |
-71.06 |
5.11 |
-8.74 |
0.25 |
0 |
|
|
364602 |
127315854 |
1 |
SN3O4C15H23 |
AB3C4D15E23 |
-145.97 |
10.12 |
-9.54 |
0.0 |
0 |
|
|
364603 |
127315855 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-90.57 |
3.63 |
-8.57 |
-0.7 |
0 |
|
|
364604 |
127315856 |
3 |
NOC7H9 |
ABC7D9 |
-85.33 |
3.58 |
-8.99 |
-0.54 |
0 |
|
|
364605 |
127315857 |
1 |
NO3C14H17 |
AB3C14D17 |
-103.33 |
3.1 |
-8.96 |
-0.1 |
0 |
|
|
364606 |
127315858 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-58.31 |
4.63 |
-9.13 |
0.11 |
0 |
|
|
364607 |
127315859 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-64.8 |
4.91 |
-9.09 |
0.21 |
0 |
|
|
364608 |
127315860 |
1 |
ON3C17H25 |
AB3C17D25 |
-32.09 |
5.25 |
-8.92 |
0.49 |
0 |
|
|
364609 |
127315861 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-64.86 |
4.49 |
-9.02 |
0.11 |
0 |
|
|
364610 |
127315862 |
1 |
ON3C16H25 |
AB3C16D25 |
-35.83 |
5.69 |
-9.0 |
0.39 |
0 |
|
|
364611 |
127315863 |
1 |
NO3C15H19 |
AB3C15D19 |
-102.32 |
3.68 |
-8.81 |
0.17 |
0 |
|
|
364612 |
127315864 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-60.88 |
4.1 |
-9.27 |
0.32 |
0 |
|
|
364613 |
127315865 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-52.17 |
4.95 |
-9.03 |
0.1 |
0 |
|
|
364614 |
127315866 |
1 |
ON4C14H22 |
AB4C14D22 |
-15.48 |
4.65 |
-8.72 |
0.26 |
0 |
|
|
364615 |
127315867 |
1 |
ON3C16H23 |
AB3C16D23 |
-28.91 |
5.89 |
-8.93 |
0.36 |
0 |
|
|
364616 |
127315868 |
1 |
ON3C13H21 |
AB3C13D21 |
-29.19 |
6.08 |
-9.01 |
0.38 |
0 |
|
|
364617 |
127315869 |
1 |
NO3C14H17 |
AB3C14D17 |
-98.14 |
5.33 |
-8.82 |
0.05 |
0 |
|
|
364618 |
127315870 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-32.46 |
1.36 |
-8.8 |
-0.78 |
0 |
|
|
364619 |
127315871 |
3 |
ON2C6H8 |
AB2C6D8 |
-61.88 |
6.6 |
-8.42 |
-0.34 |
0 |
|
|
364620 |
127315872 |
1 |
ON4C18H30 |
AB4C18D30 |
-52.79 |
2.23 |
-9.51 |
0.5 |
0 |
|
|
364621 |
127315873 |
1 |
ON4C19H32 |
AB4C19D32 |
-59.02 |
1.77 |
-9.54 |
0.48 |
0 |
|
|
364622 |
127315874 |
1 |
NO3C15H19 |
AB3C15D19 |
-107.1 |
4.22 |
-8.87 |
0.02 |
0 |
|
|
364623 |
127315875 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-59.97 |
5.05 |
-9.15 |
0.22 |
0 |
|
|
364624 |
127315876 |
1 |
ON4C16H26 |
AB4C16D26 |
-19.68 |
3.13 |
-8.63 |
0.67 |
0 |
|
|
364625 |
127315877 |
1 |
O2N6C15H22 |
A2B6C15D22 |
1.93 |
5.53 |
-8.91 |
0.18 |
0 |
|
|
364626 |
127315909 |
1 |
NSO3C17H23 |
ABC3D17E23 |
-104.3 |
3.5 |
-9.5 |
-0.38 |
0 |
|
|
364627 |
127315910 |
1 |
NS2O3C13H23 |
AB2C3D13E23 |
-134.25 |
5.07 |
-8.5 |
0.7 |
0 |
|
|
364628 |
127315911 |
1 |
NO4C23H31 |
AB4C23D31 |
-168.08 |
6.52 |
-8.62 |
-0.08 |
0 |
|
|
364629 |
127315924 |
1 |
N2O3C23H24 |
A2B3C23D24 |
-64.39 |
2.16 |
-8.77 |
-0.76 |
0 |
|
|
364630 |
127315925 |
1 |
NSO2C14H17 |
ABC2D14E17 |
-58.3 |
5.36 |
-8.79 |
0.07 |
0 |
|
|
364631 |
127315926 |
1 |
OSN3C11H17 |
ABC3D11E17 |
-12.85 |
3.56 |
-8.74 |
0.24 |
0 |
|
|
364632 |
127315927 |
1 |
N3O3C23H23 |
A3B3C23D23 |
-43.26 |
6.39 |
-8.73 |
-0.48 |
0 |
|
|
364633 |
127315928 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-24.95 |
1.95 |
-8.93 |
0.05 |
0 |
|
|
364634 |
127315929 |
1 |
O4N5C16H21 |
A4B5C16D21 |
-134.47 |
1.22 |
-9.12 |
-0.2 |
0 |
|
|
364635 |
127315930 |
1 |
N3O5C19H19 |
A3B5C19D19 |
-158.05 |
6.34 |
-9.27 |
-0.66 |
0 |
|
|
364636 |
127315931 |
1 |
ON4C16H26 |
AB4C16D26 |
-25.47 |
6.36 |
-8.65 |
0.56 |
0 |
|
|
364637 |
127315932 |
1 |
NO3C16H21 |
AB3C16D21 |
-117.34 |
3.92 |
-8.88 |
0.02 |
0 |
|
|
364638 |
127315933 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-72.66 |
4.98 |
-9.07 |
0.29 |
0 |
|
|
364639 |
127315934 |
1 |
O3N4C17H18 |
A3B4C17D18 |
-7.86 |
3.87 |
-9.36 |
-0.64 |
0 |
|
|
364640 |
127315935 |
1 |
NO2C14H17 |
AB2C14D17 |
-64.5 |
5.39 |
-8.73 |
0.25 |
0 |