List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
29523 |
834708 |
1 |
N6C15H22 |
A6B15C22 |
87.61 |
9.5 |
-8.33 |
0.05 |
0 |
|
|
29524 |
834720 |
1 |
NSH17C18 |
ABC17D18 |
64.74 |
2.09 |
-8.11 |
-0.4 |
0 |
|
|
29525 |
834728 |
1 |
NO4C18H21 |
AB4C18D21 |
-116.43 |
8.8 |
-8.38 |
-0.54 |
0 |
|
|
29526 |
834731 |
1 |
N2O2H12C15 |
A2B2C12D15 |
-31.78 |
4.44 |
-8.61 |
-1.29 |
0 |
|
|
29527 |
834753 |
1 |
NOCl2C16H17 |
ABC2D16E17 |
-21.93 |
3.75 |
-9.18 |
-0.29 |
0 |
|
|
29528 |
834766 |
1 |
FNOH14C15 |
ABCD14E15 |
-57.8 |
2.53 |
-8.6 |
-0.67 |
0 |
|
|
29529 |
834798 |
1 |
N4C13H24 |
A4B13C24 |
12.23 |
2.21 |
-8.48 |
1.06 |
0 |
|
|
29530 |
834826 |
1 |
F3O4H7C12 |
A3B4C7D12 |
-264.06 |
8.05 |
-9.59 |
-1.46 |
0 |
|
|
29531 |
834857 |
1 |
ClFN2O3H10C16 |
ABC2D3E10F16 |
-58.66 |
4.95 |
-9.15 |
-1.98 |
0 |
|
|
29532 |
834877 |
1 |
NSO2C18H21 |
ABC2D18E21 |
-52.21 |
4.17 |
-8.3 |
0.02 |
0 |
|
|
29533 |
834880 |
1 |
NO3H17C21 |
AB3C17D21 |
-34.14 |
4.96 |
-8.48 |
-1.03 |
0 |
|
|
29534 |
834892 |
1 |
NO2C19H23 |
AB2C19D23 |
-63.69 |
3.26 |
-8.73 |
-0.08 |
0 |
|
|
29535 |
834902 |
1 |
ClSO2N3H14C15 |
ABC2D3E14F15 |
-29.24 |
3.53 |
-8.85 |
-1.28 |
0 |
|
|
29536 |
834916 |
1 |
ClSN2O2H15C16 |
ABC2D2E15F16 |
-33.73 |
9.53 |
-8.25 |
-0.81 |
0 |
|
|
29537 |
834934 |
1 |
N3O4C18H19 |
A3B4C18D19 |
-94.61 |
5.95 |
-8.46 |
-0.79 |
0 |
|
|
29538 |
834942 |
1 |
BrClNOH11C14 |
ABCDE11F14 |
24.02 |
6.27 |
-9.09 |
-0.94 |
0 |
|
|
29539 |
834943 |
1 |
OSCl2N2H10C14 |
ABC2D2E10F14 |
3.65 |
1.95 |
-8.96 |
-1.14 |
0 |
|
|
29540 |
834946 |
1 |
SN2O3H14C17 |
AB2C3D14E17 |
-6.4 |
3.6 |
-8.38 |
-0.95 |
0 |
|
|
29541 |
834953 |
1 |
NO2Cl3H12C15 |
AB2C3D12E15 |
-54.39 |
3.32 |
-9.45 |
-0.59 |
0 |
|
|
29542 |
834968 |
1 |
N2O4H14C15 |
A2B4C14D15 |
-45.57 |
11.48 |
-9.17 |
-1.08 |
0 |
|
|
29543 |
835012 |
1 |
ClN2O2H13C15 |
AB2C2D13E15 |
-17.71 |
2.81 |
-9.09 |
-0.87 |
0 |
|
|
29544 |
835013 |
1 |
ClN2O2H13C15 |
AB2C2D13E15 |
-20.84 |
2.62 |
-9.16 |
-0.87 |
0 |
|
|
29545 |
835048 |
1 |
FSN2O2H13C15 |
ABC2D2E13F15 |
-64.4 |
3.05 |
-8.64 |
-1.14 |
0 |
|
|
29546 |
835052 |
1 |
ClOSN2H13C15 |
ABCD2E13F15 |
2.15 |
3.36 |
-8.84 |
-0.94 |
0 |
|
|
29547 |
835063 |
2 |
NC9H11 |
AB9C11 |
53.7 |
2.75 |
-7.93 |
-0.37 |
0 |
|
|
29548 |
835066 |
1 |
NOC18H23 |
ABC18D23 |
-17.85 |
2.48 |
-7.9 |
0.28 |
0 |
|
|
29549 |
835070 |
1 |
FOSN2H11C14 |
ABCD2E11F14 |
-25.89 |
2.37 |
-8.86 |
-1.2 |
0 |
|
|
29550 |
835086 |
1 |
FOSN2H13C15 |
ABCD2E13F15 |
-37.23 |
1.56 |
-8.82 |
-0.98 |
0 |
|
|
29551 |
835095 |
2 |
NOH9C11 |
ABC9D11 |
40.92 |
2.74 |
-8.63 |
-0.92 |
0 |
|
|
29552 |
835099 |
1 |
FOSCl2N2H9C14 |
ABCD2E2F9G14 |
-40.09 |
4.26 |
-8.99 |
-1.18 |
0 |
|
|
29553 |
835103 |
1 |
SN3O3C17H17 |
AB3C3D17E17 |
-65.79 |
12.0 |
-8.12 |
-0.72 |
0 |
|
|
29554 |
835111 |
1 |
FOS2N3H12C16 |
ABC2D3E12F16 |
-5.64 |
7.05 |
-8.73 |
-1.26 |
0 |
|
|
29555 |
835116 |
1 |
N2F3O3H11C13 |
A2B3C3D11E13 |
-244.82 |
6.81 |
-9.03 |
-0.71 |
0 |
|
|
29556 |
835137 |
1 |
ON2C12H12 |
AB2C12D12 |
3.29 |
5.08 |
-8.38 |
-0.43 |
0 |
|
|
29557 |
835146 |
1 |
OSN4C14H18 |
ABC4D14E18 |
6.22 |
6.37 |
-8.54 |
-0.68 |
0 |
|
|
29558 |
835152 |
1 |
O3N4C10H12 |
A3B4C10D12 |
-68.85 |
2.61 |
-8.96 |
-0.66 |
0 |
|
|
29559 |
835182 |
1 |
FNO2H18C21 |
ABC2D18E21 |
-64.57 |
5.65 |
-9.01 |
-0.33 |
0 |
|
|
29560 |
835251 |
1 |
NSC17H19 |
ABC17D19 |
31.23 |
4.13 |
-8.14 |
0.04 |
0 |
|
|
29561 |
835286 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-72.77 |
4.24 |
-9.75 |
-0.74 |
0 |
|
|
29562 |
835291 |
1 |
ClNO2C10H12 |
ABC2D10E12 |
-80.41 |
3.12 |
-9.01 |
-0.26 |
0 |
|
|
29563 |
835329 |
1 |
N2O2C15H16 |
A2B2C15D16 |
-39.37 |
6.54 |
-8.75 |
-0.51 |
0 |
|
|
29564 |
835330 |
1 |
NO2H13C14 |
AB2C13D14 |
-31.87 |
2.56 |
-8.88 |
-0.54 |
0 |
|
|
29565 |
835331 |
1 |
ClNOH16C19 |
ABCD16E19 |
-1.98 |
4.04 |
-8.94 |
-0.87 |
0 |
|
|
29566 |
835333 |
1 |
ClNOH16C19 |
ABCD16E19 |
-1.86 |
5.66 |
-8.9 |
-0.73 |
0 |
|
|
29567 |
835342 |
1 |
ClNSO2F3H9C13 |
ABCD2E3F9G13 |
-195.69 |
7.78 |
-9.26 |
-1.08 |
0 |
|
|
29568 |
835365 |
1 |
NO4C18H19 |
AB4C18D19 |
-130.18 |
5.56 |
-9.09 |
-0.64 |
0 |
|
|
29569 |
835369 |
1 |
NO2H15C18 |
AB2C15D18 |
-13.29 |
4.7 |
-8.49 |
-0.79 |
0 |
|
|
29570 |
835370 |
1 |
NOC17H19 |
ABC17D19 |
-17.36 |
4.07 |
-8.72 |
0.08 |
0 |
|
|
29571 |
835372 |
1 |
ClNO2H14C15 |
ABC2D14E15 |
-47.06 |
1.74 |
-9.09 |
-0.4 |
0 |
|
|
29572 |
835380 |
1 |
BrNO2C16H16 |
ABC2D16E16 |
-44.02 |
4.83 |
-8.99 |
-0.37 |
0 |
|
|
29573 |
835389 |
1 |
NO3C18H19 |
AB3C18D19 |
-88.89 |
4.66 |
-9.23 |
-0.66 |
0 |
|
|
29574 |
835404 |
1 |
NOC14H21 |
ABC14D21 |
-63.57 |
3.55 |
-8.54 |
0.32 |
0 |
|
|
29575 |
835415 |
1 |
NO3C15H19 |
AB3C15D19 |
-127.48 |
5.14 |
-9.02 |
-0.1 |
0 |
|
|
29576 |
835416 |
1 |
NO3C17H17 |
AB3C17D17 |
-92.92 |
5.78 |
-9.06 |
-0.6 |
0 |
|
|
29577 |
835417 |
1 |
NSC14H17 |
ABC14D17 |
36.54 |
4.29 |
-8.47 |
-0.43 |
0 |
|
|
29578 |
835428 |
1 |
NO2C15H15 |
AB2C15D15 |
-39.74 |
3.16 |
-8.73 |
-0.48 |
0 |
|
|
29579 |
835429 |
1 |
FNOH12C14 |
ABCD12E14 |
-48.07 |
2.78 |
-8.69 |
-0.75 |
0 |
|
|
29580 |
835430 |
1 |
NSO2C13H21 |
ABC2D13E21 |
-94.36 |
6.33 |
-9.8 |
-0.42 |
0 |
|
|
29581 |
835439 |
1 |
NO2C16H17 |
AB2C16D17 |
-49.67 |
5.23 |
-8.48 |
-0.27 |
0 |
|
|
29582 |
835457 |
1 |
NO3C17H19 |
AB3C17D19 |
-86.67 |
4.28 |
-8.72 |
-0.42 |
0 |
|
|
29583 |
835473 |
1 |
NO3C16H17 |
AB3C16D17 |
-81.57 |
4.9 |
-8.22 |
-0.24 |
0 |
|
|
29584 |
835488 |
1 |
NO3C13H19 |
AB3C13D19 |
-120.16 |
3.49 |
-8.98 |
-0.18 |
0 |
|
|
29585 |
835491 |
1 |
NO2C16H17 |
AB2C16D17 |
-48.73 |
5.58 |
-8.4 |
-0.22 |
0 |
|
|
29586 |
835521 |
1 |
NO4C17H19 |
AB4C17D19 |
-119.6 |
4.57 |
-8.48 |
-0.31 |
0 |
|
|
29587 |
835527 |
2 |
OH7C9 |
AB7C9 |
-20.73 |
2.41 |
-8.7 |
-0.74 |
0 |
|
|
29588 |
835542 |
1 |
NO5C14H21 |
AB5C14D21 |
-222.44 |
1.89 |
-8.5 |
0.37 |
0 |
|
|
29589 |
835581 |
1 |
BrNO2H12C13 |
ABC2D12E13 |
-25.25 |
3.47 |
-8.85 |
-1.01 |
0 |
|
|
29590 |
835597 |
1 |
ON2C15H16 |
AB2C15D16 |
-13.06 |
4.59 |
-8.32 |
-0.13 |
0 |
|
|
29591 |
835598 |
1 |
ClN3O3H10C14 |
AB3C3D10E14 |
31.37 |
5.78 |
-9.48 |
-1.78 |
0 |
|
|
29592 |
835600 |
1 |
FNO2H14C20 |
ABC2D14E20 |
-45.9 |
3.03 |
-9.27 |
-0.92 |
0 |
|
|
29593 |
835651 |
1 |
NOC16H17 |
ABC16D17 |
-9.02 |
3.44 |
-8.81 |
0.0 |
0 |
|
|
29594 |
835657 |
1 |
NOC18H21 |
ABC18D21 |
-20.83 |
4.24 |
-8.68 |
-0.05 |
0 |
|
|
29595 |
835660 |
1 |
NO2C18H21 |
AB2C18D21 |
-67.75 |
2.7 |
-8.53 |
0.13 |
0 |
|
|
29596 |
835664 |
1 |
NOC14H25 |
ABC14D25 |
-95.62 |
4.08 |
-9.57 |
1.35 |
0 |
|
|
29597 |
835684 |
1 |
ClN2O2C14H19 |
AB2C2D14E19 |
-105.52 |
2.42 |
-8.69 |
-0.22 |
0 |
|
|
29598 |
835690 |
1 |
ClNOC15H18 |
ABCD15E18 |
-37.75 |
3.59 |
-9.37 |
-0.6 |
0 |
|
|
29599 |
835717 |
2 |
OC8H8 |
AB8C8 |
-54.56 |
3.12 |
-8.88 |
-0.61 |
0 |
|
|
29600 |
835718 |
1 |
FO2H13C15 |
AB2C13D15 |
-93.12 |
1.93 |
-9.0 |
-0.9 |
0 |
|
|
29601 |
835721 |
1 |
O3C16H16 |
A3B16C16 |
-84.83 |
1.4 |
-8.9 |
-0.7 |
0 |
|
|
29602 |
835724 |
1 |
NO3C17H19 |
AB3C17D19 |
-85.03 |
4.34 |
-8.49 |
-0.02 |
0 |
|
|
29603 |
835742 |
1 |
NO2C18H21 |
AB2C18D21 |
-63.04 |
3.26 |
-8.73 |
-0.51 |
0 |
|
|
29604 |
835744 |
1 |
NO3H15C22 |
AB3C15D22 |
6.78 |
4.42 |
-9.12 |
-0.97 |
0 |
|
|
29605 |
835745 |
1 |
NO3H15C22 |
AB3C15D22 |
4.52 |
3.69 |
-8.97 |
-1.13 |
0 |
|
|
29606 |
835756 |
1 |
N2O5H10C15 |
A2B5C10D15 |
-47.46 |
4.5 |
-9.16 |
-1.84 |
0 |
|
|
29607 |
835758 |
1 |
BrNO2H14C15 |
ABC2D14E15 |
-36.98 |
3.73 |
-9.02 |
-0.42 |
0 |
|
|
29608 |
835769 |
1 |
BrClON2H8C12 |
ABCD2E8F12 |
14.39 |
1.5 |
-9.24 |
-1.26 |
0 |
|
|
29609 |
835777 |
1 |
NOC17H19 |
ABC17D19 |
-19.59 |
3.94 |
-8.72 |
-0.02 |
0 |
|
|
29610 |
835779 |
1 |
ClNO4C16H16 |
ABC4D16E16 |
-119.43 |
9.05 |
-8.15 |
-0.28 |
0 |
|
|
29611 |
835782 |
1 |
N2O4H10C15 |
A2B4C10D15 |
-21.05 |
5.19 |
-9.22 |
-2.09 |
0 |
|
|
29612 |
835790 |
1 |
NO2C17H19 |
AB2C17D19 |
-54.67 |
3.39 |
-8.74 |
0.05 |
0 |
|
|
29613 |
835796 |
1 |
ON2C16H18 |
AB2C16D18 |
-4.2 |
4.76 |
-9.1 |
-0.07 |
0 |
|
|
29614 |
835799 |
1 |
N2F3O4H7C15 |
A2B3C4D7E15 |
-177.11 |
1.0 |
-9.86 |
-2.67 |
0 |
|
|
29615 |
835802 |
1 |
BrNOC16H16 |
ABCD16E16 |
-7.38 |
4.62 |
-8.92 |
-0.27 |
0 |
|
|
29616 |
835808 |
1 |
OSN2C14H16 |
ABC2D14E16 |
-19.64 |
3.74 |
-8.93 |
-0.73 |
0 |
|
|
29617 |
835813 |
1 |
N2O4H10C15 |
A2B4C10D15 |
-25.05 |
3.21 |
-9.08 |
-2.44 |
0 |
|
|
29618 |
835825 |
1 |
FN3O4H10C14 |
AB3C4D10E14 |
-143.82 |
3.78 |
-9.73 |
-2.14 |
0 |
|
|
29619 |
835835 |
1 |
NO2C17H19 |
AB2C17D19 |
-55.26 |
4.48 |
-8.76 |
0.02 |
0 |
|
|
29620 |
835836 |
1 |
ClNO2C17H18 |
ABC2D17E18 |
-65.33 |
4.07 |
-8.92 |
-0.28 |
0 |
|
|
29621 |
835845 |
1 |
NO2C17H19 |
AB2C17D19 |
-49.58 |
3.37 |
-8.76 |
0.14 |
0 |
|
|
29622 |
835853 |
1 |
ClNO2C16H16 |
ABC2D16E16 |
-56.46 |
5.16 |
-9.14 |
-0.3 |
0 |