List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
287575 |
104247580 |
1 |
NO3C14H17 |
AB3C14D17 |
-110.3 |
3.66 |
-8.57 |
-0.41 |
0 |
|
|
287576 |
104247596 |
1 |
NO3C12H15 |
AB3C12D15 |
-128.26 |
2.39 |
-8.62 |
-0.25 |
0 |
|
|
287577 |
104247601 |
1 |
ClNOC12H16 |
ABCD12E16 |
-56.11 |
6.74 |
-8.63 |
-0.26 |
0 |
|
|
287578 |
104247653 |
1 |
ON2C14H22 |
AB2C14D22 |
-48.84 |
5.57 |
-8.55 |
-0.25 |
0 |
|
|
287579 |
104247674 |
1 |
ON2C18H22 |
AB2C18D22 |
-21.11 |
6.33 |
-8.61 |
-0.3 |
0 |
|
|
287580 |
104247684 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-22.69 |
3.66 |
-8.63 |
-0.26 |
0 |
|
|
287581 |
104247692 |
1 |
ON2C17H20 |
AB2C17D20 |
-16.09 |
5.98 |
-8.54 |
-0.21 |
0 |
|
|
287582 |
104247712 |
1 |
FN2O3H13C15 |
AB2C3D13E15 |
-57.01 |
8.09 |
-9.0 |
-1.62 |
0 |
|
|
287583 |
104247713 |
1 |
OCl2N2H12C14 |
AB2C2D12E14 |
-8.23 |
5.81 |
-8.66 |
-0.88 |
0 |
|
|
287584 |
104247727 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-16.16 |
8.3 |
-8.96 |
-0.6 |
0 |
|
|
287585 |
104247751 |
1 |
OSN2C11H14 |
ABC2D11E14 |
-25.93 |
2.42 |
-8.77 |
-0.49 |
0 |
|
|
287586 |
104247757 |
1 |
FOSN2H15C16 |
ABCD2E15F16 |
-38.61 |
4.65 |
-8.62 |
-1.02 |
0 |
|
|
287587 |
104247826 |
1 |
NSO2C16H17 |
ABC2D16E17 |
-44.41 |
5.75 |
-8.53 |
-1.05 |
0 |
|
|
287588 |
104247831 |
1 |
FNO2H16C17 |
ABC2D16E17 |
-92.87 |
4.58 |
-8.68 |
-0.93 |
0 |
|
|
287589 |
104247834 |
1 |
NSCl2O2H11C14 |
ABC2D2E11F14 |
-37.01 |
2.67 |
-8.78 |
-1.28 |
0 |
|
|
287590 |
104247852 |
1 |
NO2C13H19 |
AB2C13D19 |
-103.52 |
4.4 |
-8.42 |
-0.05 |
0 |
|
|
287591 |
104247881 |
1 |
BrFNOH13C15 |
ABCDE13F15 |
-49.94 |
5.37 |
-8.75 |
-0.62 |
0 |
|
|
287592 |
104247904 |
1 |
ON2C18H18 |
AB2C18D18 |
42.56 |
5.11 |
-8.64 |
-0.45 |
0 |
|
|
287593 |
104247931 |
1 |
NO2C18H21 |
AB2C18D21 |
-74.7 |
5.32 |
-8.66 |
-0.31 |
0 |
|
|
287594 |
104247972 |
1 |
OSN4C14H18 |
ABC4D14E18 |
9.82 |
3.32 |
-8.58 |
-0.61 |
0 |
|
|
287595 |
104248002 |
1 |
ON3C16H19 |
AB3C16D19 |
2.74 |
5.15 |
-8.67 |
-0.34 |
0 |
|
|
287596 |
104248021 |
1 |
ClOSN2C15H17 |
ABCD2E15F17 |
-4.82 |
5.21 |
-8.67 |
-0.59 |
0 |
|
|
287597 |
104248051 |
1 |
ON2C17H26 |
AB2C17D26 |
-58.76 |
3.79 |
-8.56 |
-0.2 |
0 |
|
|
287598 |
104248255 |
1 |
N3O5C12H15 |
A3B5C12D15 |
-117.18 |
4.62 |
-9.37 |
-1.74 |
0 |
|
|
287599 |
104248256 |
1 |
SN3O4C13H13 |
AB3C4D13E13 |
-44.87 |
6.04 |
-8.95 |
-1.86 |
0 |
|
|
287600 |
104248290 |
1 |
N2O5C12H14 |
A2B5C12D14 |
-111.27 |
4.97 |
-9.03 |
-1.5 |
0 |
|
|
287601 |
104248314 |
1 |
N2O5C13H18 |
A2B5C13D18 |
-123.77 |
5.59 |
-9.06 |
-1.49 |
0 |
|
|
287602 |
104248343 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-102.98 |
7.04 |
-9.09 |
-1.53 |
0 |
|
|
287603 |
104248360 |
1 |
N3O4C10H13 |
A3B4C10D13 |
-52.96 |
6.62 |
-9.12 |
-1.51 |
0 |
|
|
287604 |
104248458 |
2 |
ON2C6H11 |
AB2C6D11 |
-30.48 |
2.15 |
-8.96 |
-0.35 |
0 |
|
|
287605 |
104248485 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-32.45 |
2.17 |
-8.62 |
-0.74 |
0 |
|
|
287606 |
104248549 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-50.25 |
2.76 |
-9.2 |
-0.27 |
0 |
|
|
287607 |
104248594 |
1 |
N3O3C9H17 |
A3B3C9D17 |
-72.12 |
4.71 |
-9.93 |
-0.43 |
0 |
|
|
287608 |
104248639 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-16.7 |
1.4 |
-8.75 |
-0.42 |
0 |
|
|
287609 |
104248688 |
1 |
O2N3C11H21 |
A2B3C11D21 |
-48.13 |
3.68 |
-9.2 |
-0.26 |
0 |
|
|
287610 |
104248743 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-66.32 |
4.4 |
-9.5 |
-0.3 |
0 |
|
|
287611 |
104248828 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-51.17 |
1.98 |
-9.48 |
-0.27 |
0 |
|
|
287612 |
104248834 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-61.3 |
3.23 |
-9.17 |
-0.25 |
0 |
|
|
287613 |
104248848 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-15.05 |
2.84 |
-8.71 |
-0.73 |
0 |
|
|
287614 |
104248874 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-57.54 |
2.9 |
-9.59 |
-0.26 |
0 |
|
|
287615 |
104248895 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-54.36 |
2.6 |
-9.16 |
-0.16 |
0 |
|
|
287616 |
104248941 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-56.99 |
3.23 |
-9.54 |
-0.14 |
0 |
|
|
287617 |
104248944 |
1 |
SO2N4C12H16 |
AB2C4D12E16 |
-2.93 |
4.82 |
-9.03 |
-0.46 |
0 |
|
|
287618 |
104248951 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-60.35 |
1.03 |
-9.88 |
-0.39 |
0 |
|
|
287619 |
104248966 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-70.69 |
3.71 |
-9.53 |
-0.24 |
0 |
|
|
287620 |
104248971 |
1 |
O2F3N3C11H16 |
A2B3C3D11E16 |
-197.57 |
2.85 |
-9.99 |
-0.84 |
0 |
|
|
287621 |
104248974 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-52.56 |
4.11 |
-9.64 |
-0.16 |
0 |
|
|
287622 |
104249031 |
1 |
N2O4C13H18 |
A2B4C13D18 |
-99.77 |
1.22 |
-9.9 |
-0.57 |
0 |
|
|
287623 |
104249102 |
2 |
NOC6H10 |
ABC6D10 |
-92.88 |
9.69 |
-9.3 |
0.21 |
0 |
|
|
287624 |
104249130 |
1 |
N2O3C11H18 |
A2B3C11D18 |
-134.96 |
2.3 |
-9.55 |
-0.68 |
0 |
|
|
287625 |
104249144 |
1 |
BrN2O2C16H17 |
AB2C2D16E17 |
-43.04 |
10.47 |
-9.26 |
-0.5 |
0 |
|
|
287626 |
104249165 |
1 |
BrN2O3C12H17 |
AB2C3D12E17 |
-108.84 |
10.22 |
-9.5 |
-0.5 |
0 |
|
|
287627 |
104249174 |
1 |
IN2O2C13H17 |
AB2C2D13E17 |
-42.09 |
10.16 |
-9.12 |
-0.8 |
0 |
|
|
287628 |
104249229 |
1 |
OCl2N2C10H12 |
AB2C2D10E12 |
-32.23 |
2.04 |
-9.85 |
-1.13 |
0 |
|
|
287629 |
104249242 |
1 |
BrOCl2N2C10H11 |
ABC2D2E10F11 |
-20.03 |
2.46 |
-9.86 |
-1.2 |
0 |
|
|
287630 |
104249299 |
1 |
ClOSN2C12H15 |
ABCD2E12F15 |
-28.72 |
1.48 |
-9.11 |
-0.95 |
0 |
|
|
287631 |
104249317 |
2 |
OC6H11 |
AB6C11 |
-118.62 |
3.53 |
-9.69 |
0.83 |
0 |
|
|
287632 |
104249475 |
2 |
OC7H10 |
AB7C10 |
-89.26 |
2.22 |
-9.22 |
0.2 |
0 |
|
|
287633 |
104249517 |
1 |
O2C13H18 |
A2B13C18 |
-80.54 |
3.66 |
-9.28 |
0.46 |
0 |
|
|
287634 |
104249557 |
2 |
NOC6H10 |
ABC6D10 |
-70.37 |
3.99 |
-9.3 |
0.61 |
0 |
|
|
287635 |
104249592 |
1 |
NSO2C11H15 |
ABC2D11E15 |
-65.8 |
1.8 |
-9.62 |
-0.7 |
0 |
|
|
287636 |
104249632 |
1 |
NO2C13H17 |
AB2C13D17 |
-72.7 |
3.71 |
-9.89 |
-0.78 |
0 |
|
|
287637 |
104249674 |
2 |
NOC6H9 |
ABC6D9 |
-60.8 |
1.64 |
-9.05 |
0.8 |
0 |
|
|
287638 |
104249679 |
1 |
O2C15H20 |
A2B15C20 |
-89.86 |
4.42 |
-9.37 |
-0.1 |
0 |
|
|
287639 |
104249692 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-76.14 |
3.3 |
-9.57 |
-0.37 |
0 |
|
|
287640 |
104249696 |
1 |
O2C11H18 |
A2B11C18 |
-94.24 |
3.91 |
-9.82 |
0.57 |
0 |
|
|
287641 |
104249752 |
1 |
NO2C16H17 |
AB2C16D17 |
-45.77 |
1.1 |
-9.45 |
-1.0 |
0 |
|
|
287642 |
104249766 |
1 |
Cl2O2C13H14 |
A2B2C13D14 |
-87.69 |
5.0 |
-9.62 |
-0.9 |
0 |
|
|
287643 |
104249803 |
1 |
NO2C13H17 |
AB2C13D17 |
-70.1 |
2.78 |
-9.77 |
-0.28 |
0 |
|
|
287644 |
104250015 |
2 |
NOC5H9 |
ABC5D9 |
-84.05 |
2.96 |
-9.11 |
0.77 |
0 |
|
|
287645 |
104250041 |
1 |
BrO2C12H17 |
AB2C12D17 |
-86.92 |
4.43 |
-9.41 |
0.04 |
0 |
|
|
287646 |
104250042 |
1 |
O2C13H20 |
A2B13C20 |
-98.83 |
0.41 |
-9.13 |
0.51 |
0 |
|
|
287647 |
104250043 |
2 |
OC6H9 |
AB6C9 |
-89.39 |
0.68 |
-9.29 |
0.22 |
0 |
|
|
287648 |
104250103 |
1 |
O2F3C8H15 |
A2B3C8D15 |
-284.45 |
4.15 |
-10.12 |
1.73 |
0 |
|
|
287649 |
104250147 |
2 |
OC5H9 |
AB5C9 |
-98.46 |
3.65 |
-9.68 |
2.24 |
0 |