List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
346484 |
127270988 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-82.96 |
1.76 |
-8.73 |
-1.05 |
0 |
|
|
346485 |
127270989 |
1 |
ON5C23H27 |
AB5C23D27 |
41.14 |
4.03 |
-8.79 |
-0.94 |
0 |
|
|
346486 |
127270990 |
1 |
ON5C21H29 |
AB5C21D29 |
10.11 |
4.87 |
-8.83 |
-0.24 |
0 |
|
|
346487 |
127270991 |
1 |
ON5C20H27 |
AB5C20D27 |
15.24 |
4.8 |
-8.66 |
-0.58 |
0 |
|
|
346488 |
127270992 |
1 |
ClON5C19H24 |
ABC5D19E24 |
16.27 |
2.82 |
-8.72 |
-1.0 |
0 |
|
|
346489 |
127270993 |
1 |
OSN6C14H24 |
ABC6D14E24 |
20.77 |
9.92 |
-9.28 |
-0.59 |
0 |
|
|
346490 |
127270994 |
1 |
O2N3C19H33 |
A2B3C19D33 |
-129.83 |
0.95 |
-8.78 |
1.04 |
0 |
|
|
346491 |
127270995 |
1 |
ON4C17H22 |
AB4C17D22 |
1.11 |
3.06 |
-8.53 |
-0.52 |
0 |
|
|
346492 |
127270996 |
1 |
ON5C20H27 |
AB5C20D27 |
14.9 |
4.13 |
-8.64 |
-0.62 |
0 |
|
|
346493 |
127270997 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-117.8 |
7.62 |
-8.86 |
0.15 |
0 |
|
|
346494 |
127270998 |
1 |
O2N3C18H31 |
A2B3C18D31 |
-123.98 |
1.66 |
-8.78 |
0.78 |
0 |
|
|
346495 |
127270999 |
2 |
ON2C11H15 |
AB2C11D15 |
-78.15 |
3.14 |
-8.92 |
-0.49 |
0 |
|
|
346496 |
127271000 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-85.52 |
2.82 |
-8.72 |
0.27 |
0 |
|
|
346497 |
127271001 |
1 |
O2N3C23H33 |
A2B3C23D33 |
-94.64 |
2.18 |
-8.74 |
-0.08 |
0 |
|
|
346498 |
127271002 |
1 |
S2N3O3C18H29 |
A2B3C3D18E29 |
-152.02 |
4.42 |
-8.7 |
-0.05 |
0 |
|
|
346499 |
127271003 |
2 |
ON2C8H10 |
AB2C8D10 |
-52.36 |
4.91 |
-9.04 |
-0.86 |
0 |
|
|
346500 |
127271004 |
1 |
SN3O4H15C16 |
AB3C4D15E16 |
-91.59 |
2.85 |
-8.97 |
-1.22 |
0 |
|
|
346501 |
127271005 |
2 |
ON2C7H8 |
AB2C7D8 |
-34.47 |
7.19 |
-8.94 |
-0.93 |
0 |
|
|
346502 |
127271006 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-21.76 |
8.03 |
-8.98 |
-0.8 |
0 |
|
|
346503 |
127271007 |
1 |
OSN4C20H22 |
ABC4D20E22 |
29.73 |
5.5 |
-8.5 |
-0.96 |
0 |
|
|
346504 |
127271008 |
1 |
ON5C17H19 |
AB5C17D19 |
32.45 |
4.64 |
-8.84 |
-0.68 |
0 |
|
|
346505 |
127271009 |
1 |
ON4C21H30 |
AB4C21D30 |
-19.04 |
3.77 |
-8.53 |
-0.7 |
0 |
|
|
346506 |
127271010 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-16.06 |
3.73 |
-8.9 |
-0.74 |
0 |
|
|
346507 |
127271011 |
1 |
FSO2N3C18H22 |
ABC2D3E18F22 |
-96.82 |
4.96 |
-8.47 |
-1.07 |
0 |
|
|
346508 |
127271012 |
1 |
O2N5C22H25 |
A2B5C22D25 |
-23.39 |
8.42 |
-8.35 |
-0.99 |
0 |
|
|
346509 |
127271013 |
1 |
SN3O3C18H29 |
AB3C3D18E29 |
-146.17 |
4.78 |
-9.03 |
-0.05 |
0 |
|
|
346510 |
127271014 |
1 |
O2N4C17H22 |
A2B4C17D22 |
-54.0 |
4.02 |
-8.9 |
-0.7 |
0 |
|
|
346511 |
127271015 |
2 |
ON2C10H14 |
AB2C10D14 |
-70.45 |
4.8 |
-8.84 |
-0.69 |
0 |
|
|
346512 |
127271016 |
1 |
SO2N4C13H20 |
AB2C4D13E20 |
-56.16 |
9.75 |
-9.07 |
-0.3 |
0 |
|
|
346513 |
127271017 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-60.78 |
3.07 |
-8.7 |
-0.01 |
0 |
|
|
346514 |
127271018 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-133.26 |
5.02 |
-9.07 |
-0.01 |
0 |
|
|
346515 |
127271019 |
2 |
ON2C11H12 |
AB2C11D12 |
-18.1 |
4.89 |
-9.14 |
-0.87 |
0 |
|
|
346516 |
127271020 |
1 |
ON5C20H25 |
AB5C20D25 |
8.47 |
6.47 |
-8.74 |
-1.12 |
0 |
|
|
346517 |
127271021 |
1 |
O3N5C13H17 |
A3B5C13D17 |
-28.57 |
3.23 |
-9.02 |
-0.43 |
0 |
|
|
346518 |
127271022 |
1 |
O2N6C17H20 |
A2B6C17D20 |
33.53 |
5.48 |
-9.04 |
-0.85 |
0 |
|
|
346519 |
127271023 |
2 |
ON2C9H12 |
AB2C9D12 |
-58.79 |
7.74 |
-8.91 |
-0.7 |
0 |
|
|
346520 |
127271024 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-58.44 |
2.76 |
-9.0 |
-0.89 |
0 |
|
|
346521 |
127271025 |
1 |
ClO2N3C20H20 |
AB2C3D20E20 |
-27.54 |
5.6 |
-9.02 |
-1.0 |
0 |
|
|
346522 |
127271026 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-50.36 |
6.11 |
-8.8 |
-0.75 |
0 |
|
|
346523 |
127271027 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-151.38 |
6.24 |
-9.2 |
-0.09 |
0 |
|
|
346524 |
127271028 |
1 |
FSO2N3H20C21 |
ABC2D3E20F21 |
-21.9 |
6.78 |
-9.1 |
-0.87 |
0 |
|
|
346525 |
127271029 |
1 |
FO2N3H22C23 |
AB2C3D22E23 |
-31.86 |
6.94 |
-9.44 |
-0.84 |
0 |
|
|
346526 |
127271030 |
1 |
FO2N3H22C23 |
AB2C3D22E23 |
-33.04 |
5.96 |
-9.43 |
-0.84 |
0 |
|
|
346527 |
127271031 |
1 |
FN3O3H20C22 |
AB3C3D20E22 |
-59.22 |
5.0 |
-9.63 |
-0.92 |
0 |
|
|
346528 |
127271032 |
1 |
FO2N5C21H22 |
AB2C5D21E22 |
7.08 |
6.27 |
-9.6 |
-0.85 |
0 |
|
|
346529 |
127271033 |
1 |
FSO2N4H19C20 |
ABC2D4E19F20 |
6.4 |
6.69 |
-9.66 |
-0.93 |
0 |
|
|
346530 |
127271034 |
1 |
FSO2N3H20C21 |
ABC2D3E20F21 |
-21.03 |
7.54 |
-9.12 |
-0.96 |
0 |
|
|
346531 |
127271035 |
1 |
FN3O3H20C22 |
AB3C3D20E22 |
-58.37 |
5.33 |
-9.09 |
-0.96 |
0 |
|
|
346532 |
127271036 |
1 |
FO2N3H22C23 |
AB2C3D22E23 |
-32.26 |
7.91 |
-9.46 |
-0.92 |
0 |
|
|
346533 |
127271037 |
1 |
FO2N3H22C23 |
AB2C3D22E23 |
-32.14 |
7.08 |
-9.44 |
-0.92 |
0 |
|
|
346534 |
127271038 |
1 |
FN3O3H20C22 |
AB3C3D20E22 |
-58.14 |
6.17 |
-9.64 |
-0.97 |
0 |
|
|
346535 |
127271039 |
1 |
FO2N5C21H22 |
AB2C5D21E22 |
7.99 |
7.29 |
-9.61 |
-0.94 |
0 |
|
|
346536 |
127271040 |
1 |
FSO2N4H19C20 |
ABC2D4E19F20 |
7.46 |
7.76 |
-9.74 |
-0.95 |
0 |
|
|
346537 |
127271041 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-146.04 |
2.86 |
-9.6 |
0.55 |
0 |
|
|
346538 |
127271042 |
1 |
SN3O5C16H21 |
AB3C5D16E21 |
-173.86 |
5.42 |
-9.68 |
-1.09 |
0 |
|
|
346539 |
127271043 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-152.49 |
5.5 |
-9.55 |
-0.73 |
0 |
|
|
346540 |
127271044 |
1 |
SN3O4C20H21 |
AB3C4D20E21 |
-112.4 |
4.88 |
-8.71 |
-1.13 |
0 |
|
|
346541 |
127271045 |
1 |
N3O4C16H17 |
A3B4C16D17 |
-142.63 |
4.73 |
-9.43 |
-1.64 |
0 |
|
|
346542 |
127271046 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-186.04 |
7.36 |
-9.33 |
-0.49 |
0 |
|
|
346543 |
127271047 |
1 |
S2O3N4C17H20 |
A2B3C4D17E20 |
-96.41 |
5.05 |
-8.79 |
-1.31 |
0 |
|
|
346544 |
127271048 |
1 |
SN3O4C17H25 |
AB3C4D17E25 |
-182.06 |
10.19 |
-9.29 |
-0.54 |
0 |
|
|
346545 |
127271049 |
1 |
BrN3O4H14C15 |
AB3C4D14E15 |
-126.55 |
4.85 |
-9.44 |
-2.07 |
0 |
|
|
346546 |
127271050 |
1 |
N2O3C23H30 |
A2B3C23D30 |
-134.18 |
3.84 |
-8.78 |
0.17 |
0 |
|
|
346547 |
127271051 |
2 |
ON2C9H13 |
AB2C9D13 |
-64.97 |
3.38 |
-8.81 |
0.25 |
0 |
|
|
346548 |
127271052 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-200.8 |
4.43 |
-9.39 |
0.52 |
0 |
|
|
346549 |
127271053 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-160.58 |
2.61 |
-9.33 |
0.89 |
0 |
|
|
346550 |
127271054 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-64.73 |
2.99 |
-8.82 |
-0.19 |
0 |
|
|
346551 |
127271055 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-78.83 |
5.7 |
-9.6 |
0.33 |
0 |
|
|
346552 |
127271056 |
1 |
O2N5C17H21 |
A2B5C17D21 |
-27.25 |
5.72 |
-9.46 |
-0.48 |
0 |
|
|
346553 |
127271057 |
1 |
SO2N6C10H16 |
AB2C6D10E16 |
-14.78 |
3.68 |
-9.41 |
-0.66 |
0 |
|
|
346554 |
127271058 |
1 |
ClS2N3O4C11H14 |
AB2C3D4E11F14 |
-132.23 |
1.98 |
-9.59 |
-1.6 |
0 |
|
|
346555 |
127271059 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-66.6 |
3.64 |
-8.73 |
-0.57 |
0 |
|
|
346556 |
127271060 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-149.46 |
4.74 |
-9.59 |
-0.76 |
0 |
|
|
346557 |
127271061 |
1 |
O2F3N3C18H22 |
A2B3C3D18E22 |
-225.53 |
3.38 |
-9.26 |
0.12 |
0 |
|
|
346558 |
127271062 |
1 |
SO2N3C12H15 |
AB2C3D12E15 |
-37.27 |
5.41 |
-9.44 |
-1.08 |
0 |
|
|
346559 |
127271063 |
2 |
OSN2C8H10 |
ABC2D8E10 |
-52.69 |
1.96 |
-8.96 |
-1.14 |
0 |
|
|
346560 |
127271064 |
1 |
N4O4C11H14 |
A4B4C11D14 |
-166.81 |
6.64 |
-9.4 |
-1.28 |
0 |
|
|
346561 |
127271065 |
1 |
O4N5C15H17 |
A4B5C15D17 |
-135.22 |
2.81 |
-9.67 |
-1.74 |
0 |
|
|
346562 |
127271066 |
1 |
O2N7C16H21 |
A2B7C16D21 |
2.79 |
5.09 |
-9.42 |
-1.12 |
0 |
|
|
346563 |
127271067 |
2 |
ON2C11H12 |
AB2C11D12 |
-20.02 |
7.02 |
-9.04 |
-0.9 |
0 |
|
|
346564 |
127271068 |
1 |
ON5C22H23 |
AB5C22D23 |
50.12 |
5.95 |
-8.72 |
-0.44 |
0 |
|
|
346565 |
127271069 |
1 |
O2N3C24H25 |
A2B3C24D25 |
-19.22 |
1.35 |
-8.89 |
-1.15 |
0 |
|
|
346566 |
127271070 |
1 |
SO2N4C20H26 |
AB2C4D20E26 |
-57.03 |
7.96 |
-8.89 |
-0.82 |
0 |
|
|
346567 |
127271071 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-58.12 |
5.72 |
-8.96 |
-0.34 |
0 |
|
|
346568 |
127271072 |
1 |
SO2N5C20H25 |
AB2C5D20E25 |
-33.29 |
3.09 |
-8.89 |
-0.49 |
0 |
|
|
346569 |
127271073 |
1 |
O3N6C18H26 |
A3B6C18D26 |
-100.0 |
7.34 |
-8.86 |
-0.25 |
0 |
|
|
346570 |
127271074 |
1 |
O3N6C18H26 |
A3B6C18D26 |
-98.32 |
1.98 |
-8.94 |
-0.3 |
0 |
|
|
346571 |
127271075 |
1 |
ClO2N3C20H24 |
AB2C3D20E24 |
-29.86 |
4.66 |
-8.41 |
-0.4 |
0 |
|
|
346572 |
127271076 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-66.5 |
5.0 |
-8.95 |
-0.94 |
0 |
|
|
346573 |
127271077 |
1 |
SN4O4C18H28 |
AB4C4D18E28 |
-189.47 |
8.16 |
-8.87 |
-0.05 |
0 |
|
|
346574 |
127271078 |
1 |
S2N3O4C12H21 |
A2B3C4D12E21 |
-167.99 |
6.93 |
-8.83 |
-0.21 |
0 |
|
|
346575 |
127271079 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-136.13 |
5.79 |
-9.14 |
-0.18 |
0 |
|
|
346576 |
127271080 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-141.73 |
2.66 |
-9.11 |
-0.19 |
0 |
|
|
346577 |
127271081 |
1 |
S2N3O4C13H23 |
A2B3C4D13E23 |
-163.35 |
6.29 |
-9.29 |
-0.31 |
0 |
|
|
346578 |
127271082 |
1 |
NO3C17H27 |
AB3C17D27 |
-165.62 |
5.55 |
-9.56 |
0.81 |
0 |
|
|
346579 |
127271083 |
2 |
ON2C8H11 |
AB2C8D11 |
-51.1 |
4.39 |
-9.05 |
-0.62 |
0 |
|
|
346580 |
127271084 |
1 |
N3O4C21H35 |
A3B4C21D35 |
-228.06 |
5.81 |
-9.54 |
-0.08 |
0 |
|
|
346581 |
127271085 |
1 |
N2O3C17H20 |
A2B3C17D20 |
-117.74 |
4.99 |
-9.37 |
-1.29 |
0 |
|
|
346582 |
127271086 |
1 |
FN2O3C17H21 |
AB2C3D17E21 |
-183.95 |
3.06 |
-9.41 |
-0.66 |
0 |
|
|
346583 |
127271087 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-72.34 |
5.37 |
-9.72 |
-1.16 |
0 |