List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
247600 |
103072367 |
1 |
ON2C13H20 |
AB2C13D20 |
-28.54 |
3.74 |
-8.84 |
-0.26 |
0 |
|
|
247601 |
103072371 |
3 |
NC5H7 |
AB5C7 |
43.59 |
5.95 |
-8.68 |
0.1 |
0 |
|
|
247602 |
103072372 |
1 |
N3C14H19 |
A3B14C19 |
49.8 |
5.95 |
-8.69 |
0.09 |
0 |
|
|
247603 |
103072377 |
1 |
ON2C9H16 |
AB2C9D16 |
-42.59 |
4.69 |
-9.26 |
0.89 |
0 |
|
|
247604 |
103072380 |
1 |
ON2C13H24 |
AB2C13D24 |
-67.74 |
4.43 |
-8.66 |
0.63 |
0 |
|
|
247605 |
103072383 |
1 |
ON2C12H20 |
AB2C12D20 |
-26.4 |
3.21 |
-8.95 |
0.74 |
0 |
|
|
247606 |
103072384 |
1 |
ON2C10H14 |
AB2C10D14 |
-14.51 |
3.81 |
-8.69 |
-0.08 |
0 |
|
|
247607 |
103072386 |
1 |
ON2C11H16 |
AB2C11D16 |
-15.16 |
4.11 |
-8.69 |
-0.09 |
0 |
|
|
247608 |
103072387 |
1 |
ON2C14H22 |
AB2C14D22 |
-36.96 |
4.27 |
-8.67 |
-0.07 |
0 |
|
|
247609 |
103072391 |
1 |
ON3C9H13 |
AB3C9D13 |
-1.83 |
6.79 |
-9.14 |
-0.58 |
0 |
|
|
247610 |
103072394 |
1 |
ON3C12H19 |
AB3C12D19 |
-13.84 |
4.85 |
-8.95 |
-0.75 |
0 |
|
|
247611 |
103072398 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-52.91 |
1.67 |
-9.06 |
-0.82 |
0 |
|
|
247612 |
103072399 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-44.63 |
2.0 |
-9.02 |
-0.76 |
0 |
|
|
247613 |
103072404 |
1 |
ON5C11H15 |
AB5C11D15 |
35.1 |
5.32 |
-9.23 |
-0.51 |
0 |
|
|
247614 |
103072409 |
1 |
ON2F3C10H11 |
AB2C3D10E11 |
-170.47 |
1.33 |
-9.62 |
-0.98 |
0 |
|
|
247615 |
103072415 |
1 |
OSN2C7H10 |
ABC2D7E10 |
-10.27 |
2.67 |
-9.09 |
-0.48 |
0 |
|
|
247616 |
103072423 |
1 |
OSN2C11H18 |
ABC2D11E18 |
-39.44 |
4.47 |
-8.62 |
-0.19 |
0 |
|
|
247617 |
103072426 |
1 |
OSN2C12H20 |
ABC2D12E20 |
-41.87 |
3.77 |
-8.72 |
-0.29 |
0 |
|
|
247618 |
103072429 |
1 |
N4C13H14 |
A4B13C14 |
89.94 |
5.99 |
-9.01 |
-0.27 |
0 |
|
|
247619 |
103072431 |
1 |
N4C17H22 |
A4B17C22 |
67.38 |
6.04 |
-9.01 |
-0.28 |
0 |
|
|
247620 |
103072436 |
1 |
ON3C12H19 |
AB3C12D19 |
-30.71 |
1.82 |
-9.29 |
-0.42 |
0 |
|
|
247621 |
103072441 |
1 |
ON3C8H11 |
AB3C8D11 |
2.0 |
1.16 |
-9.52 |
-0.89 |
0 |
|
|
247622 |
103072442 |
1 |
ON3C10H15 |
AB3C10D15 |
-6.25 |
3.21 |
-9.23 |
-0.68 |
0 |
|
|
247623 |
103072447 |
1 |
ON3C11H15 |
AB3C11D15 |
18.53 |
2.19 |
-9.13 |
-0.76 |
0 |
|
|
247624 |
103072448 |
1 |
N4O4C7H10 |
A4B4C7D10 |
-79.75 |
7.75 |
-10.07 |
-1.71 |
0 |
|
|
247625 |
103072451 |
2 |
N2O2C6H9 |
A2B2C6D9 |
-84.62 |
7.94 |
-9.43 |
-1.64 |
0 |
|
|
247626 |
103072454 |
1 |
N4O4C11H14 |
A4B4C11D14 |
-44.22 |
7.79 |
-9.62 |
-1.64 |
0 |
|
|
247627 |
103072457 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-69.25 |
6.25 |
-8.91 |
-1.7 |
0 |
|
|
247628 |
103072464 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-68.06 |
6.79 |
-9.35 |
-1.48 |
0 |
|
|
247629 |
103072465 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-79.6 |
6.43 |
-8.98 |
-1.53 |
0 |
|
|
247630 |
103072475 |
1 |
ClO2N4C10H15 |
AB2C4D10E15 |
37.53 |
8.69 |
-9.55 |
-0.94 |
0 |
|
|
247631 |
103072482 |
1 |
ON2C13H14 |
AB2C13D14 |
8.83 |
4.34 |
-8.97 |
-0.89 |
0 |
|
|
247632 |
103072484 |
1 |
ON2C16H20 |
AB2C16D20 |
-3.35 |
3.78 |
-8.82 |
-0.81 |
0 |
|
|
247633 |
103072486 |
1 |
ON2C16H18 |
AB2C16D18 |
22.25 |
5.3 |
-8.72 |
-0.93 |
0 |
|
|
247634 |
103072491 |
1 |
N3C13H23 |
A3B13C23 |
19.46 |
5.79 |
-8.96 |
0.59 |
0 |
|
|
247635 |
103072498 |
1 |
F3N3C11H14 |
A3B3C11D14 |
-88.88 |
5.46 |
-9.51 |
-0.06 |
0 |
|
|
247636 |
103072501 |
1 |
ON2C14H18 |
AB2C14D18 |
-8.75 |
4.82 |
-8.7 |
-0.43 |
0 |
|
|
247637 |
103072502 |
1 |
ON2C17H24 |
AB2C17D24 |
-30.64 |
4.76 |
-8.59 |
-0.43 |
0 |
|
|
247638 |
103072511 |
1 |
O2F3N3C10H14 |
A2B3C3D10E14 |
-229.85 |
1.28 |
-9.3 |
-0.47 |
0 |
|
|
247639 |
103072514 |
1 |
O2F3N3C12H18 |
A2B3C3D12E18 |
-245.09 |
1.24 |
-9.16 |
-0.46 |
0 |
|
|
247640 |
103072515 |
1 |
O2F3N3C12H16 |
A2B3C3D12E16 |
-212.42 |
1.23 |
-9.27 |
-0.49 |
0 |
|
|
247641 |
103072521 |
1 |
ON2C15H28 |
AB2C15D28 |
-68.96 |
3.74 |
-8.9 |
1.15 |
0 |
|
|
247642 |
103072529 |
1 |
ON2C11H20 |
AB2C11D20 |
-54.35 |
5.05 |
-9.34 |
0.88 |
0 |
|
|
247643 |
103072539 |
1 |
ON2C16H28 |
AB2C16D28 |
-42.28 |
3.96 |
-9.07 |
1.13 |
0 |
|
|
247644 |
103072541 |
1 |
ON2C16H30 |
AB2C16D30 |
-69.17 |
5.06 |
-8.61 |
0.85 |
0 |
|
|
247645 |
103072544 |
1 |
ON2C17H32 |
AB2C17D32 |
-67.44 |
3.63 |
-8.91 |
0.83 |
0 |
|
|
247646 |
103072548 |
1 |
IN3C9H14 |
AB3C9D14 |
65.22 |
4.07 |
-9.15 |
-0.68 |
0 |
|
|
247647 |
103072549 |
1 |
IN3C8H12 |
AB3C8D12 |
73.25 |
3.78 |
-9.16 |
-0.7 |
0 |
|
|
247648 |
103072557 |
3 |
NC4H7 |
AB4C7 |
27.54 |
2.09 |
-9.07 |
0.38 |
0 |
|
|
247649 |
103072563 |
3 |
NC3H5 |
AB3C5 |
46.75 |
4.59 |
-9.28 |
0.79 |
0 |
|
|
247650 |
103072564 |
3 |
NC4H7 |
AB4C7 |
25.59 |
3.12 |
-9.0 |
0.53 |
0 |
|
|
247651 |
103072565 |
1 |
N3C11H19 |
A3B11C19 |
36.08 |
3.45 |
-9.12 |
0.6 |
0 |
|
|
247652 |
103072572 |
1 |
ClN3C11H18 |
AB3C11D18 |
29.24 |
4.29 |
-8.87 |
0.41 |
0 |
|
|
247653 |
103072573 |
1 |
ClN3C11H18 |
AB3C11D18 |
27.56 |
4.3 |
-8.93 |
0.61 |
0 |
|
|
247654 |
103072579 |
1 |
ClN3C11H18 |
AB3C11D18 |
29.16 |
2.16 |
-9.04 |
0.31 |
0 |
|
|
247655 |
103072588 |
1 |
N2O2C9H12 |
A2B2C9D12 |
-43.35 |
3.38 |
-9.38 |
-0.48 |
0 |
|
|
247656 |
103072590 |
2 |
NOC5H7 |
ABC5D7 |
-44.41 |
2.21 |
-9.06 |
-0.36 |
0 |
|
|
247657 |
103072592 |
2 |
NOC6H9 |
ABC6D9 |
-55.19 |
3.44 |
-8.78 |
-0.46 |
0 |
|
|
247658 |
103072594 |
1 |
ON2C12H22 |
AB2C12D22 |
-60.05 |
5.21 |
-9.3 |
0.9 |
0 |
|
|
247659 |
103072596 |
1 |
ON2C13H24 |
AB2C13D24 |
-58.28 |
3.84 |
-9.03 |
1.05 |
0 |
|
|
247660 |
103072600 |
2 |
NOC5H8 |
ABC5D8 |
-88.6 |
2.41 |
-9.59 |
0.14 |
0 |
|
|
247661 |
103072602 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-89.64 |
2.02 |
-9.17 |
0.15 |
0 |
|
|
247662 |
103072607 |
1 |
O2N3C12H15 |
A2B3C12D15 |
-25.54 |
4.08 |
-9.22 |
-0.7 |
0 |
|
|
247663 |
103072610 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-28.92 |
3.05 |
-9.13 |
-0.73 |
0 |
|
|
247664 |
103072611 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-32.59 |
4.38 |
-9.18 |
-0.7 |
0 |
|
|
247665 |
103072612 |
1 |
BrON3C14H16 |
ABC3D14E16 |
12.55 |
2.92 |
-9.04 |
-1.14 |
0 |
|
|
247666 |
103072615 |
1 |
BrON3C15H18 |
ABC3D15E18 |
7.06 |
3.23 |
-9.04 |
-1.0 |
0 |
|
|
247667 |
103072616 |
1 |
BrON3C15H18 |
ABC3D15E18 |
2.87 |
3.92 |
-9.23 |
-1.01 |
0 |
|
|
247668 |
103072619 |
1 |
BrO2N3C10H14 |
AB2C3D10E14 |
-63.24 |
5.24 |
-9.35 |
-0.87 |
0 |
|
|
247669 |
103072621 |
1 |
BrO2N3C11H16 |
AB2C3D11E16 |
-68.16 |
5.56 |
-9.33 |
-0.86 |
0 |
|
|
247670 |
103072628 |
1 |
N4C13H24 |
A4B13C24 |
24.56 |
4.73 |
-9.27 |
0.68 |
0 |
|
|
247671 |
103072629 |
1 |
ON5C9H11 |
AB5C9D11 |
54.73 |
1.32 |
-9.16 |
-1.19 |
0 |
|
|
247672 |
103072633 |
1 |
ON5C12H17 |
AB5C12D17 |
37.65 |
3.08 |
-9.01 |
-1.05 |
0 |
|
|
247673 |
103072634 |
1 |
ON5C12H15 |
AB5C12D15 |
70.7 |
1.42 |
-9.19 |
-1.25 |
0 |
|
|
247674 |
103072636 |
1 |
BrON3C10H14 |
ABC3D10E14 |
2.71 |
2.0 |
-9.03 |
-1.17 |
0 |