List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
365692 |
127318417 |
2 |
ON2C7H7 |
AB2C7D7 |
32.39 |
2.61 |
-9.33 |
-1.41 |
0 |
|
|
365693 |
127318418 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-86.0 |
5.54 |
-9.77 |
-0.42 |
0 |
|
|
365694 |
127318419 |
1 |
BrN2O3H15C16 |
AB2C3D15E16 |
-25.12 |
1.78 |
-9.13 |
-1.55 |
0 |
|
|
365695 |
127318420 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-95.15 |
5.5 |
-9.43 |
-0.36 |
0 |
|
|
365696 |
127318421 |
1 |
SO2N4C13H16 |
AB2C4D13E16 |
17.24 |
5.14 |
-9.75 |
-1.39 |
0 |
|
|
365697 |
127318422 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-92.16 |
6.98 |
-9.74 |
-0.47 |
0 |
|
|
365698 |
127318423 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-84.57 |
4.6 |
-9.92 |
-0.8 |
0 |
|
|
365699 |
127318424 |
1 |
NOSC10H13 |
ABCD10E13 |
-32.14 |
5.05 |
-8.68 |
-0.11 |
0 |
|
|
365700 |
127318425 |
1 |
OSN4C15H16 |
ABC4D15E16 |
71.95 |
6.7 |
-8.98 |
-0.75 |
0 |
|
|
365701 |
127318426 |
1 |
SN3O3C16H17 |
AB3C3D16E17 |
-16.26 |
2.65 |
-8.93 |
-0.91 |
0 |
|
|
365702 |
127318427 |
1 |
SN2O3C17H24 |
AB2C3D17E24 |
-100.21 |
4.58 |
-8.74 |
-0.25 |
0 |
|
|
365703 |
127318428 |
1 |
NSO5C16H25 |
ABC5D16E25 |
-222.25 |
2.36 |
-9.63 |
0.43 |
0 |
|
|
365704 |
127318429 |
1 |
N2O3C18H30 |
A2B3C18D30 |
-144.0 |
4.36 |
-8.66 |
0.99 |
0 |
|
|
365705 |
127318430 |
1 |
SN2O2C19H20 |
AB2C2D19E20 |
-28.34 |
2.02 |
-8.6 |
-0.7 |
0 |
|
|
365706 |
127318431 |
1 |
SN2O4C20H26 |
AB2C4D20E26 |
-147.16 |
6.47 |
-9.17 |
-0.56 |
0 |
|
|
365707 |
127318432 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-141.74 |
4.98 |
-8.59 |
-0.65 |
0 |
|
|
365708 |
127318433 |
1 |
N3O3C19H31 |
A3B3C19D31 |
-139.34 |
4.9 |
-9.0 |
0.74 |
0 |
|
|
365709 |
127318434 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-86.51 |
4.28 |
-9.08 |
-0.61 |
0 |
|
|
365710 |
127318435 |
1 |
SN3O5C17H25 |
AB3C5D17E25 |
-160.45 |
3.26 |
-9.49 |
-0.65 |
0 |
|
|
365711 |
127318436 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-25.09 |
3.1 |
-8.95 |
-0.48 |
0 |
|
|
365712 |
127318437 |
1 |
N3O3C16H23 |
A3B3C16D23 |
-86.5 |
3.55 |
-9.97 |
-0.5 |
0 |
|
|
365713 |
127318438 |
1 |
SN3O3C17H25 |
AB3C3D17E25 |
-97.24 |
2.61 |
-8.92 |
-0.58 |
0 |
|
|
365714 |
127318439 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-109.42 |
4.04 |
-8.61 |
-0.02 |
0 |
|
|
365715 |
127318440 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-186.39 |
2.8 |
-9.28 |
-0.65 |
0 |
|
|
365716 |
127318441 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-118.17 |
3.49 |
-9.45 |
0.58 |
0 |
|
|
365717 |
127318442 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-50.51 |
3.8 |
-8.66 |
-0.72 |
0 |
|
|
365718 |
127318443 |
2 |
ON2C8H9 |
AB2C8D9 |
-11.49 |
8.22 |
-9.14 |
-0.48 |
0 |
|
|
365719 |
127318444 |
1 |
SN3O4C18H31 |
AB3C4D18E31 |
-177.46 |
3.88 |
-9.22 |
-0.13 |
0 |
|
|
365720 |
127318445 |
1 |
O3N4C17H26 |
A3B4C17D26 |
-78.14 |
2.86 |
-8.65 |
-0.77 |
0 |
|
|
365721 |
127318446 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-48.35 |
0.36 |
-8.59 |
-0.54 |
0 |
|
|
365722 |
127318447 |
1 |
N2O4C19H24 |
A2B4C19D24 |
-149.05 |
4.91 |
-8.78 |
-0.1 |
0 |
|
|
365723 |
127318448 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-103.55 |
4.02 |
-8.75 |
-0.34 |
0 |
|
|
365724 |
127318449 |
1 |
N3O4C17H19 |
A3B4C17D19 |
-145.97 |
4.34 |
-9.32 |
-0.47 |
0 |
|
|
365725 |
127318450 |
1 |
SN4O4C18H22 |
AB4C4D18E22 |
-107.87 |
2.56 |
-9.13 |
-0.97 |
0 |
|
|
365726 |
127318451 |
1 |
N2O3C19H30 |
A2B3C19D30 |
-160.73 |
4.74 |
-9.58 |
0.74 |
0 |
|
|
365727 |
127318452 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-53.46 |
3.43 |
-9.38 |
-0.38 |
0 |
|
|
365728 |
127318453 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-30.98 |
3.02 |
-9.22 |
-1.12 |
0 |
|
|
365729 |
127318454 |
1 |
SN2O3C18H24 |
AB2C3D18E24 |
-117.46 |
4.61 |
-9.53 |
-0.81 |
0 |
|
|
365730 |
127318455 |
1 |
ClN2O2S2C17H17 |
AB2C2D2E17F17 |
-32.93 |
3.57 |
-9.18 |
-0.99 |
0 |
|
|
365731 |
127318456 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-4.67 |
3.02 |
-8.46 |
-0.52 |
0 |
|
|
365732 |
127318457 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-48.82 |
2.92 |
-8.76 |
-1.05 |
0 |
|
|
365733 |
127318458 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-112.66 |
3.22 |
-8.58 |
0.13 |
0 |
|
|
365734 |
127318459 |
1 |
ClSO2N3C17H20 |
ABC2D3E17F20 |
-11.28 |
2.43 |
-8.75 |
-1.14 |
0 |
|
|
365735 |
127318460 |
1 |
N2O3C17H26 |
A2B3C17D26 |
-99.03 |
3.15 |
-9.57 |
-0.55 |
0 |
|
|
365736 |
127318461 |
2 |
ON2C8H12 |
AB2C8D12 |
-62.48 |
4.45 |
-9.63 |
0.44 |
0 |
|
|
365737 |
127318462 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-86.9 |
1.96 |
-8.85 |
0.7 |
0 |
|
|
365738 |
127318463 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-123.32 |
6.92 |
-8.22 |
0.06 |
0 |
|
|
365739 |
127318464 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-124.86 |
6.24 |
-8.51 |
0.17 |
0 |
|
|
365740 |
127318465 |
1 |
N4O4C19H26 |
A4B4C19D26 |
-136.46 |
3.77 |
-8.7 |
-0.49 |
0 |
|
|
365741 |
127318466 |
2 |
ON2C9H10 |
AB2C9D10 |
2.95 |
2.97 |
-8.64 |
-0.34 |
0 |
|
|
365742 |
127318467 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-26.12 |
4.6 |
-9.52 |
-0.92 |
0 |
|
|
365743 |
127318468 |
1 |
ClN2O3C19H25 |
AB2C3D19E25 |
-115.61 |
4.56 |
-8.82 |
-0.2 |
0 |
|
|
365744 |
127318469 |
2 |
ON2C7H10 |
AB2C7D10 |
-52.73 |
1.83 |
-9.6 |
0.41 |
0 |
|
|
365745 |
127318470 |
1 |
O3N4C17H24 |
A3B4C17D24 |
-97.68 |
4.67 |
-8.9 |
0.21 |
0 |
|
|
365746 |
127318471 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-85.98 |
4.64 |
-8.21 |
-0.16 |
0 |
|
|
365747 |
127318472 |
1 |
N3O3C16H23 |
A3B3C16D23 |
-80.55 |
4.59 |
-9.45 |
-0.4 |
0 |
|
|
365748 |
127318473 |
1 |
ClN2O3C21H29 |
AB2C3D21E29 |
-124.56 |
1.52 |
-9.16 |
-0.34 |
0 |
|
|
365749 |
127318474 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-77.49 |
2.21 |
-10.1 |
-0.38 |
0 |
|
|
365750 |
127318475 |
1 |
N2S2O4C13H22 |
A2B2C4D13E22 |
-178.2 |
1.32 |
-8.66 |
0.22 |
0 |
|
|
365751 |
127318476 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-58.92 |
2.63 |
-8.48 |
-0.25 |
0 |
|
|
365752 |
127318477 |
1 |
N2O3C20H34 |
A2B3C20D34 |
-158.96 |
2.4 |
-8.65 |
0.92 |
0 |
|
|
365753 |
127318478 |
1 |
N3O3C20H33 |
A3B3C20D33 |
-147.64 |
6.86 |
-8.8 |
0.8 |
0 |
|
|
365754 |
127318479 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-95.36 |
5.89 |
-8.8 |
-0.54 |
0 |
|
|
365755 |
127318480 |
1 |
NSO5C18H23 |
ABC5D18E23 |
-191.75 |
7.44 |
-9.51 |
-0.62 |
0 |
|
|
365756 |
127318481 |
1 |
O2S2N3C13H13 |
A2B2C3D13E13 |
-10.59 |
8.23 |
-8.57 |
-0.66 |
0 |
|
|
365757 |
127318482 |
1 |
SN2O3C21H24 |
AB2C3D21E24 |
-82.41 |
4.03 |
-8.74 |
-0.91 |
0 |
|
|
365758 |
127318483 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-15.4 |
1.03 |
-9.02 |
-0.59 |
0 |
|
|
365759 |
127318484 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-45.73 |
6.75 |
-9.75 |
0.27 |
0 |
|
|
365760 |
127318485 |
1 |
O3N4C17H26 |
A3B4C17D26 |
-70.48 |
2.04 |
-9.12 |
-0.32 |
0 |
|
|
365761 |
127318486 |
1 |
SO2N3C18H29 |
AB2C3D18E29 |
-54.99 |
0.63 |
-8.6 |
-0.6 |
0 |
|
|
365762 |
127318487 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-73.06 |
9.44 |
-8.64 |
-0.45 |
0 |
|
|
365763 |
127318488 |
3 |
NOC7H9 |
ABC7D9 |
-94.72 |
3.88 |
-8.84 |
-0.04 |
0 |
|
|
365764 |
127318489 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-124.66 |
4.03 |
-9.09 |
0.04 |
0 |
|
|
365765 |
127318490 |
1 |
N3O3C19H33 |
A3B3C19D33 |
-163.72 |
7.69 |
-8.98 |
1.21 |
0 |
|
|
365766 |
127318491 |
1 |
SN2O2C16H18 |
AB2C2D16E18 |
-53.43 |
1.85 |
-8.86 |
-0.65 |
0 |