List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
55501 |
17395474 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-62.95 |
4.99 |
-10.16 |
-0.94 |
0 |
|
|
55502 |
17395475 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-2.34 |
6.05 |
-9.1 |
-0.66 |
0 |
|
|
55503 |
17395476 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-160.7 |
3.22 |
-8.34 |
0.16 |
0 |
|
|
55504 |
17395477 |
1 |
FSN6H11C15 |
ABC6D11E15 |
119.03 |
3.15 |
-9.21 |
-1.18 |
0 |
|
|
55505 |
17395478 |
1 |
SN6H14C16 |
AB6C14D16 |
155.52 |
6.06 |
-9.19 |
-1.02 |
0 |
|
|
55506 |
17395479 |
1 |
OSN6H14C16 |
ABC6D14E16 |
124.54 |
5.55 |
-9.12 |
-0.97 |
0 |
|
|
55507 |
17395480 |
1 |
SN6H14C15 |
AB6C14D15 |
129.13 |
4.16 |
-8.68 |
-0.83 |
0 |
|
|
55508 |
17395482 |
1 |
FOS2N5H10C15 |
ABC2D5E10F15 |
115.78 |
6.32 |
-9.48 |
-1.34 |
0 |
|
|
55509 |
17395483 |
1 |
OSN6C18H18 |
ABC6D18E18 |
110.16 |
7.48 |
-9.04 |
-0.83 |
0 |
|
|
55510 |
17395484 |
1 |
ON3C21H23 |
AB3C21D23 |
19.86 |
3.31 |
-8.91 |
-0.94 |
0 |
|
|
55511 |
17395486 |
1 |
SN3O4H11C16 |
AB3C4D11E16 |
-54.99 |
6.3 |
-9.29 |
-1.51 |
0 |
|
|
55512 |
17395487 |
1 |
O4N5C17H19 |
A4B5C17D19 |
-18.93 |
6.01 |
-8.82 |
-1.42 |
0 |
|
|
55513 |
17395489 |
1 |
N3O3H13C16 |
A3B3C13D16 |
-32.38 |
5.58 |
-9.94 |
-0.76 |
0 |
|
|
55514 |
17395490 |
1 |
SN2O4C13H16 |
AB2C4D13E16 |
-71.36 |
6.09 |
-9.01 |
-1.59 |
0 |
|
|
55515 |
17395491 |
2 |
NOC8H12 |
ABC8D12 |
-112.27 |
1.65 |
-9.18 |
0.1 |
0 |
|
|
55516 |
17395492 |
1 |
O2S2N3C15H17 |
A2B2C3D15E17 |
-26.9 |
4.36 |
-8.24 |
-0.78 |
0 |
|
|
55517 |
17395493 |
1 |
SN3O3C19H21 |
AB3C3D19E21 |
-72.47 |
6.52 |
-8.9 |
-0.41 |
0 |
|
|
55518 |
17395494 |
1 |
OS2N5H15C17 |
AB2C5D15E17 |
101.99 |
6.51 |
-9.02 |
-1.01 |
0 |
|
|
55519 |
17395495 |
1 |
ON3C19H19 |
AB3C19D19 |
17.81 |
3.15 |
-8.3 |
-0.86 |
0 |
|
|
55520 |
17395496 |
1 |
O2S2N3C16H17 |
A2B2C3D16E17 |
-36.07 |
2.72 |
-9.0 |
-0.87 |
0 |
|
|
55521 |
17395497 |
1 |
FS2N6H13C14 |
AB2C6D13E14 |
60.57 |
2.55 |
-8.71 |
-0.85 |
0 |
|
|
55522 |
17395499 |
1 |
O2N3C19H19 |
A2B3C19D19 |
-6.32 |
3.94 |
-9.26 |
-0.92 |
0 |
|
|
55523 |
17395500 |
1 |
FO2S2N3H12C14 |
AB2C2D3E12F14 |
-60.82 |
4.46 |
-8.83 |
-0.88 |
0 |
|
|
55524 |
17395501 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-153.66 |
0.51 |
-9.26 |
0.08 |
0 |
|
|
55525 |
17395502 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-131.0 |
3.55 |
-9.22 |
0.08 |
0 |
|
|
55526 |
17395503 |
1 |
N2O4C15H22 |
A2B4C15D22 |
-180.76 |
4.02 |
-9.27 |
0.07 |
0 |
|
|
55527 |
17395504 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-230.91 |
4.9 |
-9.2 |
0.04 |
0 |
|
|
55528 |
17395505 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-145.46 |
1.02 |
-9.28 |
0.09 |
0 |
|
|
55529 |
17395506 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-103.15 |
3.21 |
-8.96 |
-0.25 |
0 |
|
|
55530 |
17395508 |
1 |
ClSN3O3H12C13 |
ABC3D3E12F13 |
-82.12 |
5.45 |
-9.26 |
-0.81 |
0 |
|
|
55531 |
17395509 |
1 |
N3O3H15C16 |
A3B3C15D16 |
-58.58 |
2.78 |
-9.24 |
-0.98 |
0 |
|
|
55532 |
17395510 |
1 |
O2N3H13C19 |
A2B3C13D19 |
61.25 |
1.23 |
-8.76 |
-1.0 |
0 |
|
|
55533 |
17395511 |
1 |
SN2O3H16C19 |
AB2C3D16E19 |
-30.99 |
7.81 |
-9.07 |
-1.02 |
0 |
|
|
55534 |
17395512 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-41.36 |
4.16 |
-8.7 |
-0.7 |
0 |
|
|
55535 |
17395513 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-42.29 |
6.13 |
-8.54 |
-0.79 |
0 |
|
|
55536 |
17395514 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-38.39 |
3.17 |
-8.53 |
-0.08 |
0 |
|
|
55537 |
17395515 |
1 |
SF2N2O3H10C14 |
AB2C2D3E10F14 |
-126.15 |
6.01 |
-9.0 |
-0.92 |
0 |
|
|
55538 |
17395516 |
1 |
ClO3N4C16H19 |
AB3C4D16E19 |
-114.18 |
6.57 |
-9.55 |
-0.6 |
0 |
|
|
55539 |
17395517 |
1 |
F2O2N3H13C17 |
A2B2C3D13E17 |
-116.26 |
8.72 |
-8.97 |
-1.04 |
0 |
|
|
55540 |
17395518 |
1 |
FN2O2C15H15 |
AB2C2D15E15 |
-78.84 |
6.3 |
-8.9 |
-0.6 |
0 |
|
|
55541 |
17395519 |
1 |
N3O4C19H19 |
A3B4C19D19 |
-109.03 |
7.02 |
-8.18 |
-0.72 |
0 |
|
|
55542 |
17395520 |
1 |
N2O2S2H14C19 |
A2B2C2D14E19 |
39.65 |
3.54 |
-8.95 |
-1.2 |
0 |
|
|
55543 |
17395521 |
2 |
ON2H8C10 |
AB2C8D10 |
47.64 |
5.42 |
-9.09 |
-0.75 |
0 |
|
|
55544 |
17395522 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-80.14 |
8.79 |
-8.53 |
-0.08 |
0 |
|
|
55545 |
17395523 |
2 |
NO2C10H10 |
AB2C10D10 |
-137.39 |
3.48 |
-9.1 |
-0.81 |
0 |
|
|
55546 |
17395524 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-83.54 |
7.76 |
-8.35 |
-0.1 |
0 |
|
|
55547 |
17395525 |
1 |
NO5C18H21 |
AB5C18D21 |
-177.15 |
9.01 |
-8.86 |
-0.26 |
0 |
|
|
55548 |
17395528 |
1 |
SN2O2H12C15 |
AB2C2D12E15 |
-5.59 |
5.88 |
-8.83 |
-1.01 |
0 |
|
|
55549 |
17395529 |
1 |
OSN2H12C13 |
ABC2D12E13 |
16.74 |
5.53 |
-9.14 |
-0.57 |
0 |
|
|
55550 |
17395530 |
1 |
S2N3O3C16H19 |
A2B3C3D16E19 |
-52.24 |
8.72 |
-8.94 |
-1.04 |
0 |
|
|
55551 |
17395531 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-111.63 |
3.18 |
-9.21 |
-0.36 |
0 |
|
|
55552 |
17395532 |
1 |
SN2O2H12C15 |
AB2C2D12E15 |
-8.35 |
2.92 |
-8.43 |
-0.74 |
0 |
|
|
55553 |
17395533 |
1 |
SO2N3H15C17 |
AB2C3D15E17 |
-14.96 |
6.2 |
-9.37 |
-1.09 |
0 |
|
|
55554 |
17395534 |
1 |
SO2N4H16C18 |
AB2C4D16E18 |
7.69 |
3.24 |
-9.24 |
-1.22 |
0 |
|
|
55555 |
17395536 |
1 |
ON3C22H27 |
AB3C22D27 |
-4.15 |
2.67 |
-8.24 |
0.18 |
0 |
|
|
55556 |
17395537 |
1 |
FN2O3H15C16 |
AB2C3D15E16 |
-113.45 |
2.56 |
-8.52 |
-0.28 |
0 |
|
|
55557 |
17395538 |
1 |
FN2O2C17H17 |
AB2C2D17E17 |
-92.69 |
4.33 |
-8.59 |
-0.88 |
0 |
|
|
55558 |
17395539 |
1 |
ClN2O3H13C15 |
AB2C3D13E15 |
-66.3 |
3.62 |
-8.52 |
-0.32 |
0 |
|
|
55559 |
17395540 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-42.41 |
3.64 |
-9.48 |
0.16 |
0 |
|
|
55560 |
17395550 |
1 |
SN2O3H20C21 |
AB2C3D20E21 |
-50.9 |
6.65 |
-8.41 |
-0.5 |
0 |
|
|
55561 |
17395551 |
1 |
OS2N4C11H18 |
AB2C4D11E18 |
-5.1 |
5.49 |
-8.52 |
-0.88 |
0 |
|
|
55562 |
17395552 |
1 |
ON2S2C10H16 |
AB2C2D10E16 |
-35.98 |
4.91 |
-8.89 |
-0.78 |
0 |
|
|
55563 |
17395556 |
1 |
ON3C17H27 |
AB3C17D27 |
-42.89 |
2.22 |
-8.84 |
0.28 |
0 |
|
|
55564 |
17395561 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-168.56 |
2.41 |
-9.61 |
-1.04 |
0 |
|
|
55565 |
17395567 |
1 |
N2O3C17H18 |
A2B3C17D18 |
-79.5 |
3.37 |
-8.97 |
-0.08 |
0 |
|
|
55566 |
17395568 |
1 |
SN3O3C27H31 |
AB3C3D27E31 |
-56.77 |
7.39 |
-8.61 |
-0.85 |
0 |
|
|
55567 |
17395570 |
1 |
FOSN4H15C16 |
ABCD4E15F16 |
28.05 |
3.28 |
-8.77 |
-0.75 |
0 |
|
|
55568 |
17395573 |
1 |
OSN5C19H21 |
ABC5D19E21 |
58.78 |
3.02 |
-8.79 |
-0.76 |
0 |
|
|
55569 |
17395574 |
1 |
OSN5H17C18 |
ABC5D17E18 |
91.45 |
6.22 |
-8.59 |
-0.84 |
0 |
|
|
55570 |
17395577 |
1 |
OSN4C20H22 |
ABC4D20E22 |
43.29 |
5.2 |
-9.1 |
-0.83 |
0 |
|
|
55571 |
17395578 |
1 |
SO2F3N3C14H14 |
AB2C3D3E14F14 |
-163.86 |
6.68 |
-9.37 |
-0.9 |
0 |
|
|
55572 |
17395579 |
1 |
OSN4C20H22 |
ABC4D20E22 |
40.82 |
2.74 |
-8.84 |
-0.64 |
0 |
|
|
55573 |
17395581 |
1 |
SO2N4C19H26 |
AB2C4D19E26 |
-35.92 |
5.29 |
-8.73 |
-0.26 |
0 |
|
|
55574 |
17395582 |
1 |
OSN4C20H22 |
ABC4D20E22 |
38.09 |
3.62 |
-9.14 |
-0.77 |
0 |
|
|
55575 |
17395583 |
1 |
OSN3C14H15 |
ABC3D14E15 |
11.88 |
3.34 |
-9.03 |
-0.8 |
0 |
|
|
55576 |
17395586 |
1 |
OSN5C12H21 |
ABC5D12E21 |
-3.08 |
3.16 |
-9.39 |
-0.68 |
0 |
|
|
55577 |
17395587 |
1 |
FO2N3C15H18 |
AB2C3D15E18 |
-55.5 |
2.78 |
-9.48 |
-0.22 |
0 |
|
|
55578 |
17395590 |
1 |
SN4C16H18 |
AB4C16D18 |
78.66 |
3.7 |
-8.67 |
-0.66 |
0 |
|
|
55579 |
17395591 |
1 |
BrOSN5C20H20 |
ABCD5E20F20 |
63.34 |
1.09 |
-8.64 |
-0.78 |
0 |
|
|
55580 |
17395592 |
1 |
ClSO2N3C20H22 |
ABC2D3E20F22 |
-27.63 |
5.59 |
-8.61 |
-0.53 |
0 |
|
|
55581 |
17395593 |
1 |
ON3C16H21 |
AB3C16D21 |
-19.22 |
3.5 |
-8.76 |
-0.83 |
0 |
|
|
55582 |
17395594 |
1 |
ClSO2N4C21H23 |
ABC2D4E21F23 |
-0.67 |
4.04 |
-8.67 |
-0.76 |
0 |
|
|
55583 |
17395595 |
1 |
OS2N5C21H25 |
AB2C5D21E25 |
47.52 |
5.34 |
-8.41 |
-0.62 |
0 |
|
|
55584 |
17395596 |
1 |
FNO2C14H14 |
ABC2D14E14 |
-88.55 |
3.44 |
-9.58 |
-0.17 |
0 |
|
|
55585 |
17395599 |
1 |
ON4C28H30 |
AB4C28D30 |
77.8 |
4.71 |
-8.78 |
-0.92 |
0 |
|
|
55586 |
17395600 |
1 |
SO3N6C22H30 |
AB3C6D22E30 |
-72.35 |
7.09 |
-8.36 |
-0.44 |
0 |
|
|
55587 |
17395601 |
1 |
ON4C16H22 |
AB4C16D22 |
-5.69 |
3.02 |
-8.32 |
-0.92 |
0 |
|
|
55588 |
17395605 |
1 |
ClN3O4H22C23 |
AB3C4D22E23 |
-122.37 |
5.86 |
-8.28 |
-0.81 |
0 |
|
|
55589 |
17395606 |
1 |
SO3N4H22C24 |
AB3C4D22E24 |
2.71 |
8.21 |
-9.15 |
-0.97 |
0 |
|
|
55590 |
17395607 |
1 |
ClN4O4C19H23 |
AB4C4D19E23 |
-148.65 |
5.06 |
-9.48 |
-0.56 |
0 |
|
|
55591 |
17395608 |
1 |
FN2O2H13C17 |
AB2C2D13E17 |
-45.81 |
2.67 |
-9.17 |
-1.12 |
0 |
|
|
55592 |
17395613 |
1 |
ON4C21H22 |
AB4C21D22 |
44.21 |
6.28 |
-9.27 |
-0.38 |
0 |
|
|
55593 |
17395618 |
1 |
FNSO2H12C13 |
ABCD2E12F13 |
-87.17 |
3.24 |
-9.03 |
-1.14 |
0 |
|
|
55594 |
17395621 |
1 |
BrN2S2O4C17H19 |
AB2C2D4E17F19 |
-79.01 |
7.1 |
-9.44 |
-0.91 |
0 |
|
|
55595 |
17395623 |
1 |
O2N4C25H28 |
A2B4C25D28 |
-17.06 |
4.62 |
-8.94 |
-0.6 |
0 |
|
|
55596 |
17395624 |
1 |
FOS2N4H7C11 |
ABC2D4E7F11 |
53.52 |
3.71 |
-9.5 |
-1.46 |
0 |
|
|
55597 |
17395627 |
1 |
SO3N4C16H22 |
AB3C4D16E22 |
-91.48 |
4.1 |
-8.67 |
-0.31 |
0 |
|
|
55598 |
17395628 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-164.34 |
6.57 |
-9.01 |
-0.33 |
0 |
|
|
55599 |
17395632 |
2 |
NO2C7H9 |
AB2C7D9 |
-167.61 |
9.53 |
-9.34 |
-0.8 |
0 |
|
|
55600 |
17395636 |
1 |
FO2N3C14H16 |
AB2C3D14E16 |
-54.96 |
7.37 |
-9.39 |
-0.2 |
0 |