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 |
|
|
364641 |
127315936 |
1 |
ON3C13H21 |
AB3C13D21 |
-34.09 |
5.61 |
-9.16 |
0.5 |
0 |
|
|
364642 |
127315937 |
1 |
SN2O5C16H18 |
AB2C5D16E18 |
-168.77 |
7.47 |
-9.7 |
-1.0 |
0 |
|
|
364643 |
127315938 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-102.14 |
2.54 |
-9.06 |
-0.65 |
0 |
|
|
364644 |
127315939 |
1 |
NO2C15H19 |
AB2C15D19 |
-74.85 |
5.61 |
-8.75 |
0.16 |
0 |
|
|
364645 |
127315940 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-49.11 |
2.97 |
-9.1 |
-0.53 |
0 |
|
|
364646 |
127315941 |
3 |
NOC7H9 |
ABC7D9 |
-96.4 |
4.39 |
-9.09 |
-0.71 |
0 |
|
|
364647 |
127315942 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-91.08 |
3.61 |
-8.97 |
-0.57 |
0 |
|
|
364648 |
127315943 |
1 |
N4O4C19H32 |
A4B4C19D32 |
-202.29 |
7.19 |
-8.75 |
0.91 |
0 |
|
|
364649 |
127315944 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-72.16 |
2.97 |
-8.83 |
0.18 |
0 |
|
|
364650 |
127315945 |
3 |
NOC7H9 |
ABC7D9 |
-94.48 |
4.73 |
-9.07 |
-0.7 |
0 |
|
|
364651 |
127315946 |
1 |
NSO2C14H17 |
ABC2D14E17 |
-63.97 |
2.96 |
-8.91 |
-0.08 |
0 |
|
|
364652 |
127315947 |
1 |
OSN3C11H17 |
ABC3D11E17 |
-18.49 |
4.3 |
-8.75 |
0.18 |
0 |
|
|
364653 |
127315948 |
1 |
ON4C18H30 |
AB4C18D30 |
-38.48 |
6.35 |
-9.62 |
0.2 |
0 |
|
|
364654 |
127315949 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-126.86 |
6.09 |
-8.85 |
-0.35 |
0 |
|
|
364655 |
127315950 |
1 |
O2N6C19H32 |
A2B6C19D32 |
-58.84 |
4.17 |
-8.65 |
0.27 |
0 |
|
|
364656 |
127315951 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-79.31 |
6.22 |
-8.71 |
-0.57 |
0 |
|
|
364657 |
127315952 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-101.98 |
4.87 |
-9.08 |
-0.68 |
0 |
|
|
364658 |
127315953 |
1 |
ON4C22H26 |
AB4C22D26 |
19.36 |
5.79 |
-9.06 |
-0.46 |
0 |
|
|
364659 |
127315954 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-55.17 |
4.32 |
-8.78 |
0.21 |
0 |
|
|
364660 |
127315955 |
1 |
ON4C12H20 |
AB4C12D20 |
-12.41 |
5.15 |
-8.79 |
0.29 |
0 |
|
|
364661 |
127315956 |
1 |
O3N5C14H23 |
A3B5C14D23 |
-98.24 |
4.8 |
-8.73 |
-0.16 |
0 |
|
|
364662 |
127315957 |
1 |
ON3C16H25 |
AB3C16D25 |
-39.46 |
5.06 |
-9.02 |
0.34 |
0 |
|
|
364663 |
127315958 |
1 |
ON4C17H28 |
AB4C17D28 |
-40.88 |
6.7 |
-9.82 |
0.46 |
0 |
|
|
364664 |
127315959 |
1 |
ON4C18H30 |
AB4C18D30 |
-47.37 |
6.81 |
-9.82 |
0.46 |
0 |
|
|
364665 |
127315960 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-49.9 |
5.0 |
-9.0 |
0.02 |
0 |
|
|
364666 |
127315961 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-74.52 |
7.31 |
-8.71 |
-0.82 |
0 |
|
|
364667 |
127315962 |
1 |
ON3C13H21 |
AB3C13D21 |
-33.57 |
5.85 |
-9.05 |
0.47 |
0 |
|
|
364668 |
127315963 |
2 |
NOC8H11 |
ABC8D11 |
-54.7 |
4.2 |
-8.79 |
0.11 |
0 |
|
|
364669 |
127315964 |
1 |
ON4C13H22 |
AB4C13D22 |
-13.33 |
5.66 |
-8.75 |
0.61 |
0 |
|
|
364670 |
127315965 |
1 |
ON3C21H29 |
AB3C21D29 |
-25.3 |
4.14 |
-9.29 |
0.4 |
0 |
|
|
364671 |
127315966 |
1 |
SO2N3C21H25 |
AB2C3D21E25 |
-62.16 |
7.19 |
-8.32 |
-0.83 |
0 |
|
|
364672 |
127315967 |
1 |
SO2N3C20H23 |
AB2C3D20E23 |
-47.49 |
7.06 |
-8.34 |
-0.88 |
0 |
|
|
364673 |
127315968 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-169.53 |
8.77 |
-8.61 |
-0.41 |
0 |
|
|
364674 |
127315969 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-170.31 |
9.99 |
-8.56 |
-0.33 |
0 |
|
|
364675 |
127315970 |
1 |
SO2N3C21H25 |
AB2C3D21E25 |
-60.53 |
5.93 |
-8.38 |
-0.53 |
0 |
|
|
364676 |
127315971 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-128.52 |
3.62 |
-8.46 |
-0.23 |
0 |
|
|
364677 |
127315972 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-131.66 |
5.47 |
-8.49 |
-0.31 |
0 |
|
|
364678 |
127315973 |
1 |
SN4O4C14H22 |
AB4C4D14E22 |
-180.28 |
3.28 |
-8.98 |
-0.09 |
0 |
|
|
364679 |
127315974 |
1 |
SN3O3C11H17 |
AB3C3D11E17 |
-137.8 |
7.35 |
-8.31 |
-0.43 |
0 |
|
|
364680 |
127315975 |
1 |
N4O4C15H22 |
A4B4C15D22 |
-160.63 |
5.46 |
-9.49 |
-0.17 |
0 |
|
|
364682 |
127315977 |
1 |
SN3O3C14H23 |
AB3C3D14E23 |
-148.22 |
5.91 |
-9.56 |
-0.58 |
0 |
|
|
364683 |
127315978 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-53.32 |
2.67 |
-9.16 |
-0.94 |
0 |
|
|
364684 |
127315979 |
1 |
SN3O3C19H33 |
AB3C3D19E33 |
-182.31 |
5.07 |
-8.9 |
0.04 |
0 |
|
|
364685 |
127315980 |
1 |
SN4O4C18H28 |
AB4C4D18E28 |
-202.59 |
6.82 |
-9.51 |
-0.47 |
0 |
|
|
364686 |
127315981 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-85.98 |
5.22 |
-8.96 |
-0.37 |
0 |
|
|
364687 |
127315982 |
1 |
SN3O4C17H29 |
AB3C4D17E29 |
-200.65 |
3.44 |
-9.13 |
-0.18 |
0 |
|
|
364688 |
127315983 |
1 |
SO2N3C19H33 |
AB2C3D19E33 |
-121.52 |
4.94 |
-8.89 |
0.1 |
0 |
|
|
364689 |
127315984 |
1 |
SN3O3C14H27 |
AB3C3D14E27 |
-149.71 |
4.4 |
-8.73 |
0.16 |
0 |
|
|
364690 |
127315985 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-76.12 |
1.3 |
-8.68 |
-0.87 |
0 |
|
|
364691 |
127315986 |
2 |
ON2C10H18 |
AB2C10D18 |
-120.35 |
3.86 |
-8.66 |
1.4 |
0 |