List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126636 |
50971060 |
1 |
ON4C18H26 |
AB4C18D26 |
-19.55 |
2.61 |
-8.96 |
-0.22 |
0 |
|
|
126637 |
50971061 |
3 |
NOC7H7 |
ABC7D7 |
-63.52 |
2.01 |
-8.99 |
-0.98 |
0 |
|
|
126638 |
50971062 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-67.0 |
2.5 |
-8.78 |
-0.15 |
0 |
|
|
126639 |
50971063 |
1 |
ON7C19H27 |
AB7C19D27 |
35.84 |
3.0 |
-8.81 |
-0.7 |
0 |
|
|
126640 |
50971064 |
1 |
ON2C17H22 |
AB2C17D22 |
-12.38 |
3.78 |
-8.51 |
0.3 |
0 |
|
|
126641 |
50971065 |
1 |
ClOSN6H13C17 |
ABCD6E13F17 |
112.85 |
9.07 |
-8.72 |
-1.34 |
0 |
|
|
126642 |
50971111 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-103.86 |
4.86 |
-9.31 |
-0.68 |
0 |
|
|
126643 |
50971244 |
1 |
N7C19H21 |
A7B19C21 |
119.7 |
7.42 |
-8.87 |
-0.54 |
0 |
|
|
126644 |
50971288 |
1 |
ON3C18H23 |
AB3C18D23 |
-4.51 |
2.14 |
-9.14 |
-0.08 |
0 |
|
|
126645 |
50971314 |
1 |
N2O4H20C21 |
A2B4C20D21 |
-110.25 |
2.95 |
-9.22 |
-0.26 |
0 |
|
|
126646 |
50971542 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-106.93 |
3.17 |
-9.8 |
-0.8 |
0 |
|
|
126647 |
50971571 |
1 |
ON3C15H29 |
AB3C15D29 |
-77.23 |
5.2 |
-8.86 |
1.47 |
0 |
|
|
126648 |
50971668 |
1 |
SN4C16H22 |
AB4C16D22 |
50.2 |
4.89 |
-8.67 |
0.04 |
0 |
|
|
126649 |
50971902 |
1 |
ClOSN6C13H17 |
ABCD6E13F17 |
42.08 |
2.38 |
-8.9 |
-0.82 |
0 |
|
|
126650 |
50971906 |
1 |
ON4C13H24 |
AB4C13D24 |
-22.68 |
4.27 |
-8.72 |
0.86 |
0 |
|
|
126651 |
50971907 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-30.34 |
4.19 |
-8.57 |
0.14 |
0 |
|
|
126652 |
50971950 |
1 |
N8H18C21 |
A8B18C21 |
197.23 |
6.83 |
-8.64 |
-0.91 |
0 |
|
|
126653 |
50971972 |
1 |
O2N4C15H22 |
A2B4C15D22 |
27.14 |
7.0 |
-9.62 |
-0.04 |
0 |
|
|
126654 |
50972039 |
1 |
ON4C24H32 |
AB4C24D32 |
10.04 |
4.61 |
-8.09 |
-0.06 |
0 |
|
|
126655 |
50972165 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-15.35 |
7.57 |
-9.11 |
-0.55 |
0 |
|
|
126656 |
50972166 |
1 |
ON4C20H28 |
AB4C20D28 |
14.49 |
4.6 |
-8.65 |
0.3 |
0 |
|
|
126657 |
50972236 |
3 |
NOC6H7 |
ABC6D7 |
-24.76 |
3.61 |
-8.03 |
-0.28 |
0 |
|
|
126658 |
50972279 |
1 |
OSN3C19H25 |
ABC3D19E25 |
9.9 |
3.22 |
-9.14 |
-0.57 |
0 |
|
|
126659 |
50972329 |
1 |
SO3N5C16H27 |
AB3C5D16E27 |
-100.38 |
5.41 |
-8.49 |
0.25 |
0 |
|
|
126660 |
50972499 |
1 |
SO2N4C18H26 |
AB2C4D18E26 |
-55.77 |
4.61 |
-9.33 |
-0.81 |
0 |
|
|
126661 |
50972567 |
1 |
SO2N3C17H21 |
AB2C3D17E21 |
-15.68 |
5.84 |
-8.72 |
-0.4 |
0 |
|
|
126662 |
50972568 |
1 |
ON4C20H26 |
AB4C20D26 |
9.34 |
4.27 |
-8.57 |
-0.47 |
0 |
|
|
126663 |
50972569 |
1 |
SO2N3C18H27 |
AB2C3D18E27 |
-70.42 |
6.82 |
-8.9 |
-0.23 |
0 |
|
|
126664 |
50972570 |
1 |
ClO2N5H14C18 |
AB2C5D14E18 |
56.03 |
7.09 |
-9.17 |
-1.38 |
0 |
|
|
126665 |
50972744 |
1 |
ON6C18H22 |
AB6C18D22 |
38.93 |
3.13 |
-9.2 |
-0.47 |
0 |
|
|
126666 |
50972853 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-24.14 |
6.82 |
-9.16 |
-0.59 |
0 |
|
|
126667 |
50972887 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-33.06 |
4.53 |
-9.4 |
-0.6 |
0 |
|
|
126668 |
50972888 |
2 |
ON2C10H14 |
AB2C10D14 |
-64.53 |
4.59 |
-8.32 |
0.03 |
0 |
|
|
126669 |
50972970 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-164.53 |
4.05 |
-9.17 |
-0.81 |
0 |
|
|
126670 |
50973033 |
1 |
ON3C19H25 |
AB3C19D25 |
4.07 |
8.23 |
-8.83 |
-0.45 |
0 |
|
|
126671 |
50973041 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-151.93 |
6.88 |
-9.46 |
-0.68 |
0 |
|
|
126672 |
50973042 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-74.97 |
1.22 |
-8.76 |
-0.2 |
0 |
|
|
126673 |
50973082 |
1 |
ON5C13H13 |
AB5C13D13 |
51.95 |
2.75 |
-9.09 |
-0.74 |
0 |
|
|
126674 |
50973083 |
1 |
O3N7C15H23 |
A3B7C15D23 |
-21.83 |
3.92 |
-8.9 |
-0.82 |
0 |
|
|
126675 |
50973084 |
2 |
ON2C12H13 |
AB2C12D13 |
-24.65 |
4.25 |
-8.75 |
-0.64 |
0 |
|
|
126676 |
50973085 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-17.96 |
5.16 |
-9.01 |
-0.45 |
0 |
|
|
126677 |
50973086 |
1 |
N5C18H27 |
A5B18C27 |
61.41 |
5.95 |
-8.93 |
0.29 |
0 |
|
|
126678 |
50973087 |
1 |
OSN4C15H18 |
ABC4D15E18 |
-1.99 |
2.95 |
-9.19 |
-0.77 |
0 |
|
|
126679 |
50973088 |
2 |
NO2C9H11 |
AB2C9D11 |
-100.02 |
6.27 |
-8.68 |
-0.21 |
0 |
|
|
126680 |
50973089 |
1 |
OSN3C24H27 |
ABC3D24E27 |
27.79 |
3.65 |
-8.99 |
-0.78 |
0 |
|
|
126681 |
50973090 |
1 |
SN4C22H28 |
AB4C22D28 |
76.43 |
5.26 |
-8.51 |
-0.49 |
0 |
|
|
126682 |
50973091 |
1 |
O3N4C15H24 |
A3B4C15D24 |
-58.87 |
3.16 |
-8.86 |
-0.3 |
0 |
|
|
126683 |
50973092 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-75.48 |
7.7 |
-9.68 |
-0.88 |
0 |
|
|
126684 |
50973093 |
1 |
O2N4H20C21 |
A2B4C20D21 |
27.37 |
5.08 |
-8.81 |
-0.85 |
0 |
|
|
126685 |
50973094 |
1 |
SN2O3C12H24 |
AB2C3D12E24 |
-158.97 |
6.79 |
-8.83 |
0.91 |
0 |
|
|
126686 |
50973095 |
1 |
OSN3C19H23 |
ABC3D19E23 |
20.49 |
2.39 |
-8.87 |
-0.49 |
0 |
|
|
126687 |
50973197 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-20.76 |
7.45 |
-8.16 |
-0.12 |
0 |
|
|
126688 |
50973228 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-94.93 |
4.22 |
-8.55 |
0.26 |
0 |
|
|
126689 |
50973229 |
1 |
FON4C14H17 |
ABC4D14E17 |
-41.91 |
3.09 |
-9.56 |
-0.78 |
0 |
|
|
126690 |
50973312 |
1 |
SN5C20H21 |
AB5C20D21 |
110.33 |
3.98 |
-8.41 |
-0.57 |
0 |
|
|
126691 |
50973313 |
1 |
OSN7C15H15 |
ABC7D15E15 |
105.77 |
4.82 |
-9.63 |
-1.46 |
0 |
|
|
126692 |
50973314 |
1 |
SO2N3C18H21 |
AB2C3D18E21 |
-38.44 |
3.53 |
-8.35 |
-0.4 |
0 |
|
|
126693 |
50973315 |
1 |
OSN4H14C16 |
ABC4D14E16 |
72.62 |
7.96 |
-9.3 |
-0.94 |
0 |
|
|
126694 |
50973316 |
1 |
ON3H17C18 |
AB3C17D18 |
34.79 |
4.14 |
-8.32 |
-1.08 |
0 |
|
|
126695 |
50973317 |
1 |
O2N6H20C21 |
A2B6C20D21 |
110.26 |
2.93 |
-9.6 |
-0.74 |
0 |
|
|
126696 |
50973318 |
1 |
N3C17H17 |
A3B17C17 |
70.81 |
3.95 |
-8.91 |
-0.82 |
0 |
|
|
126697 |
50973319 |
1 |
ON4C13H20 |
AB4C13D20 |
-7.11 |
3.16 |
-8.59 |
0.19 |
0 |
|
|
126698 |
50973320 |
1 |
FON4H21C22 |
ABC4D21E22 |
31.01 |
6.15 |
-8.31 |
-0.3 |
0 |
|
|
126699 |
50973501 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-43.32 |
1.62 |
-8.92 |
-0.41 |
0 |
|
|
126700 |
50973502 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-74.16 |
2.52 |
-8.53 |
0.26 |
0 |
|
|
126701 |
50973633 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-90.29 |
3.46 |
-8.23 |
0.01 |
0 |
|
|
126702 |
50973725 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-73.95 |
5.91 |
-8.66 |
-0.4 |
0 |
|
|
126703 |
50973846 |
2 |
ON3C10H10 |
AB3C10D10 |
24.42 |
5.96 |
-9.72 |
-0.88 |
0 |
|
|
126704 |
50973888 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-21.69 |
7.82 |
-9.4 |
-0.29 |
0 |
|
|
126705 |
50973974 |
1 |
SO3N4C16H16 |
AB3C4D16E16 |
-59.26 |
6.65 |
-8.92 |
-0.68 |
0 |
|
|
126706 |
50974042 |
1 |
N5H13C16 |
A5B13C16 |
132.73 |
4.48 |
-9.52 |
-1.54 |
0 |
|
|
126707 |
50974325 |
1 |
ON6C16H24 |
AB6C16D24 |
10.7 |
2.17 |
-8.43 |
-0.76 |
0 |
|
|
126708 |
50974454 |
1 |
ON5H21C22 |
AB5C21D22 |
72.22 |
7.0 |
-8.62 |
-0.35 |
0 |
|
|
126709 |
50974455 |
1 |
O2N4H22C23 |
A2B4C22D23 |
30.99 |
4.25 |
-8.78 |
-0.38 |
0 |
|
|
126710 |
50974456 |
1 |
ON3C16H25 |
AB3C16D25 |
-24.49 |
4.12 |
-8.75 |
-0.36 |
0 |
|
|
126711 |
50974492 |
1 |
N2O3C20H30 |
A2B3C20D30 |
-124.98 |
7.13 |
-8.72 |
0.18 |
0 |
|
|
126712 |
50974495 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-17.96 |
7.6 |
-9.08 |
-0.53 |
0 |
|
|
126713 |
50974496 |
2 |
N3C8H10 |
A3B8C10 |
68.36 |
3.94 |
-8.8 |
-0.07 |
0 |
|
|
126714 |
50974553 |
1 |
ON4C14H24 |
AB4C14D24 |
-21.64 |
2.12 |
-8.28 |
0.35 |
0 |
|
|
126715 |
50974593 |
1 |
ON4C13H20 |
AB4C13D20 |
-3.19 |
3.01 |
-8.92 |
0.3 |
0 |
|
|
126716 |
50974594 |
2 |
ON2C10H14 |
AB2C10D14 |
-46.83 |
2.89 |
-9.21 |
0.21 |
0 |
|
|
126717 |
50974606 |
1 |
N3O3H19C23 |
A3B3C19D23 |
-26.66 |
3.81 |
-8.65 |
-0.71 |
0 |
|
|
126718 |
50974653 |
3 |
NOC6H9 |
ABC6D9 |
-100.27 |
6.38 |
-8.45 |
0.15 |
0 |
|
|
126719 |
50974657 |
1 |
SO2N5C17H27 |
AB2C5D17E27 |
-53.49 |
5.13 |
-8.57 |
-0.1 |
0 |
|
|
126720 |
50974780 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-175.26 |
3.6 |
-9.82 |
0.05 |
0 |
|
|
126721 |
50974864 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-104.2 |
7.05 |
-8.7 |
0.19 |
0 |
|
|
126722 |
50974868 |
1 |
ON4C23H30 |
AB4C23D30 |
14.11 |
6.46 |
-8.7 |
-0.88 |
0 |
|
|
126723 |
50974923 |
1 |
ON3H17C20 |
AB3C17D20 |
51.64 |
3.12 |
-8.82 |
-0.95 |
0 |
|
|
126724 |
50974924 |
1 |
SN3C18H21 |
AB3C18D21 |
73.55 |
3.35 |
-8.56 |
-0.47 |
0 |
|
|
126725 |
50974925 |
2 |
NOC8H13 |
ABC8D13 |
-101.55 |
4.25 |
-9.24 |
0.24 |
0 |
|
|
126726 |
50975151 |
1 |
FN3O4C18H18 |
AB3C4D18E18 |
-157.35 |
5.39 |
-9.38 |
-1.29 |
0 |
|
|
126727 |
50975219 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-10.85 |
6.82 |
-9.4 |
-0.81 |
0 |
|
|
126728 |
50975220 |
1 |
OS2N4C13H18 |
AB2C4D13E18 |
14.39 |
4.18 |
-9.44 |
-1.09 |
0 |
|
|
126729 |
50975250 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-17.86 |
6.34 |
-9.33 |
-0.53 |
0 |
|
|
126730 |
50975251 |
3 |
NOC5H9 |
ABC5D9 |
-148.19 |
2.41 |
-9.06 |
0.68 |
0 |
|
|
126731 |
50975470 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-81.5 |
5.72 |
-8.6 |
-0.78 |
0 |
|
|
126732 |
50975471 |
1 |
N5C23H27 |
A5B23C27 |
77.49 |
5.83 |
-8.79 |
-0.52 |
0 |
|
|
126733 |
50975472 |
1 |
SO2N4C14H18 |
AB2C4D14E18 |
18.09 |
5.67 |
-9.6 |
-0.91 |
0 |
|
|
126734 |
50975579 |
1 |
N5C18H21 |
A5B18C21 |
81.12 |
2.71 |
-9.15 |
-0.9 |
0 |
|
|
126735 |
50975704 |
8 |
NC2H2 |
AB2C2 |
157.71 |
1.3 |
-8.77 |
-0.31 |
0 |